Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.42 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8537063 | 0.88 | NR4A2 (0.43) | IDO1NR4A2SOS2CYP3A4TSHR | |
| SCHEMBL31429694 | 0.82 | IDO1 (0.51) | IDO1CYP3A4TSHRALDH1A1TDP1 | |
| SCHEMBL32667989 | 0.82 | CSNK1A1 (0.42) | IDO1CYP3A4TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL8542466 | 0.82 | ALDH1A1 (0.49) | IDO1CYP3A4ALDH1A1DYRK1BCSNK1A1 | |
| SCHEMBL29084865 | 0.81 | IDO1 (0.58) | IDO1TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL31429733 | 0.81 | IDO1 (0.58) | IDO1TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL3631532 | 0.80 | RAB9A (0.50) | ALDH1A1SMN1; SMN2DYRK1BCSNK1A1TYRO3 | |
| SCHEMBL31658923 | 0.79 | IDO1 (0.57) | IDO1ALDH1A1DYRK1BCSNK1A1TYRO3 | |
| SCHEMBL8558526 | 0.79 | NPC1 (0.40) | IDO1NR4A2CYP3A4ALDH1A1DYRK1B | |
| SCHEMBL8541383 | 0.77 | KMO (0.43) | IDO1CYP3A4ALDH1A1DYRK1BCSNK1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |