Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Isonicotinonitrile. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Isonicotinonitrile SCHEMBL151611 | 0.97 | — | — | |
| Isonicotinonitrile SCHEMBL12264099 | 0.97 | — | — | |
| Isonicotinonitrile SCHEMBL2015834 | 0.97 | HDAC8 (0.52) | — | |
| Isonicotinonitrile SCHEMBL28206662 | 0.94 | HDAC8 (0.50) | — | |
| Isonicotinonitrile SCHEMBL17162916 | 0.94 | — | — | |
| Isonicotinonitrile SCHEMBL27920335 | 0.94 | HDAC8 (0.50) | — | |
| Isonicotinonitrile SCHEMBL31532552 | 0.94 | — | — | |
| Isonicotinonitrile SCHEMBL29881309 | 0.94 | — | — | |
| Isonicotinonitrile SCHEMBL28280361 | 0.94 | — | — | |
| Isonicotinonitrile SCHEMBL8430072 | 0.92 | HDAC8 (0.44) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11660379-B2 | Durable antimicrobial layer for implantable medical devices | CARDIAC PACEMAKERS, INC. (US) | 2023-05-30 | — | — | US | disclosed |
| US-20220211919-A1 | DURABLE ANTIMICROBIAL LAYER FOR IMPLANTABLE MEDICAL DEVICES | CARDIAC PACEMAKERS, INC. | 2022-07-07 | — | — | US | disclosed |
| CN-110087704-B | Anti-infective drug outflow device | 心脏起搏器股份公司 | 2022-06-10 | — | — | CN | disclosed |
| US-11324860-B2 | Durable antimicrobial layer for implantable medical devices | CARDIAC PACEMAKERS, INC. (US) | 2022-05-10 | — | — | US | disclosed |
| EP-3442611-B1 | HYDROPHILIC COATINGS THROUGH IN SITU SURFACE POLYMERIZATION | CARDIAC PACEMAKERS INC (US) | 2021-08-11 | — | — | EP | disclosed |
| EP-3496775-B1 | DURABLE ANTIMICROBIAL LAYER FOR IMPLANTABLE MEDICAL DEVICES | CARDIAC PACEMAKERS INC (US) | 2021-05-05 | — | — | EP | disclosed |
| EP-3185920-B1 | LUBRICIOUS ONE-PART HYDROPHILIC COATINGS | BOSTON SCIENT SCIMED INC (US) | 2021-03-24 | — | — | EP | disclosed |
| EP-3554572-B1 | INFECTION FIGHTING DRUG ELUTING DEVICE | CARDIAC PACEMAKERS INC (US) | 2021-03-03 | — | — | EP | disclosed |
| EP-3554572-A1 | INFECTION FIGHTING DRUG ELUTING DEVICE | Cardiac Pacemakers, Inc. (US) | 2019-10-23 | — | — | EP | disclosed |
| EP-3442611-A1 | HYDROPHILIC COATINGS THROUGH IN SITU SURFACE POLYMERIZATION | Cardiac Pacemakers, Inc. (US) | 2019-02-20 | — | — | EP | disclosed |
| US-20180169307-A1 | INFECTION FIGHTING DRUG ELUTING DEVICE | CARDIAC PACEMAKERS, INC. | 2018-06-21 | — | — | US | disclosed |
| WO-2018112355-A1 | INFECTION FIGHTING DRUG ELUTING DEVICE | CARDIAC PACEMAKERS, INC. (US) | 2018-06-21 | — | — | WO | disclosed |
| US-20180043064-A1 | DURABLE ANTIMICROBIAL LAYER FOR IMPLANTABLE MEDICAL DEVICES | CARDIAC PACEMAKERS, INC. | 2018-02-15 | — | — | US | disclosed |
| US-9839725-B2 | Lubricious one-part hydrophilic coatings | BOSTON SCIENTIFIC SCIMED, INC. (US) | 2017-12-12 | — | — | US | disclosed |
| WO-2017180686-A1 | HYDROPHILIC COATINGS THROUGH IN SITU SURFACE POLYMERIZATION | CARDIAC PACEMAKERS, INC. (US) | 2017-10-19 | — | — | WO | disclosed |
| US-20170290955-A1 | HYDROPHILIC COATINGS THROUGH IN SITU SURFACE POLYMERIZATION | CARDIAC PACEMAKERS, INC. | 2017-10-12 | — | — | US | disclosed |
| EP-3185920-A1 | LUBRICIOUS ONE-PART HYDROPHILIC COATINGS | Boston Scientific Scimed Inc. (US) | 2017-07-05 | — | — | EP | disclosed |
| US-20160058918-A1 | LUBRICIOUS ONE-PART HYDROPHILIC COATINGS | BOSTON SCIENTIFIC SCIMED, INC. (US) | 2016-03-03 | — | — | US | disclosed |
| WO-2016032720-A1 | LUBRICIOUS ONE-PART HYDROPHILIC COATINGS | BOSTON SCIENTIFIC SCIMED, INC. (US) | 2016-03-03 | — | — | WO | disclosed |