Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | F13A1 | P00488 | 1/20 | 0.47 |
| ▸ | TGM2 | P21980 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL2099309 | 0.83 | ACHE (0.47) | MEN1KMT2AKDM4ENPSR1CHRM2 | |
| SCHEMBL22391948 | 0.83 | MEN1 (0.59) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL450916 | 0.82 | SMN1; SMN2 (0.62) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL5857295 | 0.81 | SMN1; SMN2 (0.60) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL23165958 | 0.81 | SMN1; SMN2 (0.67) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL5866394 | 0.81 | SMN1; SMN2 (0.63) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL296939 | 0.81 | SMN1; SMN2 (0.65) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL342045 | 0.81 | ACHE (0.59) | SMN1; SMN2CYP2C19NPC1RAB9AGRIN2B | |
| SCHEMBL31184445 | 0.81 | KDM4E (0.53) | NPC1RAB9AHTTKMT2AKDM4E | |
| SCHEMBL2604335 | 0.81 | KDM4E (0.53) | NPC1RAB9AHTTKMT2AKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977135-A | Bicyclic heterocycles | ZENECA LTD. (GB) | 1999-11-02 | — | — | US | disclosed |
| EP-0733051-B1 | BICYCLIC HETEROCYCLES AS NEUROKININ A ANTAGONISTS | ZENECA LTD (GB) | 1999-09-15 | — | — | EP | disclosed |
| US-5602138-A | NKA affecting piperidyl heterobicyclic compounds | ZENECA LIMITED (GB) | 1997-02-11 | — | — | US | disclosed |
| EP-0733051-A1 | BICYCLIC HETEROCYCLES AS NEUROKININ A ANTAGONISTS | ZENECA LIMITED (GB) | 1996-09-25 | — | — | EP | disclosed |
| WO-1995015961-A1 | BICYCLIC HETEROCYCLES AS NEUROKININ A ANTAGONISTS | ZENECA LIMITED (GB) | 1995-06-15 | — | — | WO | disclosed |