Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 11/20 | 1.00 |
| ▸ | NOS1 | P29475 | 16/20 | 0.56 |
| ▸ | NOS2 | P35228 | 10/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.56 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.56 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.56 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.56 |
| ▸ | HTR1B | P28222 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8177597 | 0.95 | NOS3 (0.91) | NOS3NOS1NOS2CHRM2ADRA2A | |
| SCHEMBL8188464 | 0.92 | NOS3 (0.86) | NOS3NOS1NOS2CHRM2ADRA2A | |
| SCHEMBL7510210 | 0.82 | NOS3 (0.69) | NOS3NOS1NOS2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL8788822 | 0.82 | NOS3 (0.69) | NOS3NOS1NOS2CYP2C19 | |
| SCHEMBL7482742 | 0.81 | NOS3 (0.68) | NOS3NOS1NOS2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL7555462 | 0.80 | NOS3 (0.67) | NOS3NOS1NOS2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL7483122 | 0.80 | NOS3 (0.67) | NOS3NOS1NOS2CHRM2ADRA2A | |
| SCHEMBL7549928 | 0.79 | NOS3 (0.65) | NOS3NOS1NOS2CHRM2ADRA2A | |
| Hydrochloric Acid SCHEMBL7552153 | 0.78 | NOS3 (0.64) | NOS3NOS1NOS2CHRM2ADRA2A | |
| SCHEMBL7511924 | 0.77 | NOS3 (0.63) | NOS3NOS1NOS2CHRM2ADRA2A |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6117898-A | Bicyclic amidine derivatives as inhibitors of nitric oxide synthetase | ASTRA AKTIEBOLAG (SE) | 2000-09-12 | — | — | US | claimed |
| EP-0759027-B1 | BICYCLIC AMIDINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHETASE | ASTRA AB (SE) | 1999-08-04 | — | — | EP | claimed |
| US-5807886-A | Bicyclic amidine dervatives as inhibitors of nitric oxide synthetase | ASTRA AKTIEBOLAG (SE) | 1998-09-15 | — | — | US | claimed |
| CN-1162310-A | Bicyclic amidine derivatives used in therapy | ASTRA AB (SE) | 1997-10-15 | — | — | CN | claimed |
| EP-0759027-A1 | BICYCLIC AMIDINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHETASE | Astra Aktiebolag (SE) | 1997-02-26 | — | — | EP | claimed |
| WO-1997006158-A1 | BICYCLIC AMIDINE DERIVATIVES USEFUL IN THERAPY | ASTRA AKTIEBOLAG (SE) | 1997-02-20 | — | — | WO | claimed |
| WO-1996001817-A1 | BICYCLIC AMIDINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHETASE | ASTRA AKTIEBOLAG (SE) | 1996-01-25 | — | — | WO | claimed |
| EP-0983266-B1 | novel tetrahydroisoquinolin thiophenecarboximidamides | ASTRAZENECA AB (SE) | 2001-12-12 | — | — | EP | disclosed |
| US-6166030-A | Compounds | ASTRA AKTIEBOLAG (SE) | 2000-12-26 | — | — | US | disclosed |
| US-6117898-A | Bicyclic amidine derivatives as inhibitors of nitric oxide synthetase | ASTRA AKTIEBOLAG (SE) | 2000-09-12 | — | — | US | disclosed |
| EP-0983266-A1 | COMPOUNDS | Astra Aktiebolag (SE) | 2000-03-08 | — | — | EP | disclosed |
| EP-0759027-B1 | BICYCLIC AMIDINE DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHETASE | ASTRA AB (SE) | 1999-08-04 | — | — | EP | disclosed |
| WO-1998050380-A1 | COMPOUNDS | ASTRA AKTIEBOLAG (SE) | 1998-11-12 | — | — | WO | disclosed |
| US-5807886-A | Bicyclic amidine dervatives as inhibitors of nitric oxide synthetase | ASTRA AKTIEBOLAG (SE) | 1998-09-15 | — | — | US | disclosed |
| CN-1162310-A | Bicyclic amidine derivatives used in therapy | ASTRA AB (SE) | 1997-10-15 | — | — | CN | disclosed |