Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 13/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 13/20 | 0.47 |
| ▸ | ITGAV | P06756 | 8/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.37 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL383510 | 0.89 | ITGB3 (0.53) | ITGB3ITGA2BITGAVHTR1AHTR2A | |
| SCHEMBL7649922 | 0.87 | ITGB3 (0.47) | ITGB3ITGA2BITGAVHTR1AHTR2A | |
| SCHEMBL7650144 | 0.86 | ITGB3 (0.55) | ITGB3ITGA2BITGAVMMP3ITGB1 | |
| SCHEMBL383368 | 0.81 | ITGB3 (0.73) | ITGB3ITGA2BITGAVMMP3ITGB1 | |
| SCHEMBL7653577 | 0.81 | NPC1 (0.41) | ITGB3ITGA2BITGAVHTR1AHTR2A | |
| SCHEMBL7653553 | 0.80 | HTR2A (0.45) | HTR1AHTR2ANPC1RAB9ACA1 | |
| SCHEMBL382418 | 0.79 | ITGB3 (0.43) | ITGB3ITGA2BITGAVHTR1AHTR2A | |
| SCHEMBL7651226 | 0.79 | ITGB3 (0.46) | ITGB3ITGA2BITGAVMMP2ALDH1A1 | |
| SCHEMBL7654405 | 0.78 | ITGB3 (0.74) | ITGB3ITGA2BITGAV | |
| SCHEMBL7653489 | 0.78 | ITGB3 (0.46) | ITGB3ITGA2BITGAVNPC1RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6451800-B1 | Phenylpiperazine derivatives as integrin αvβ3 antagonists | MEIJI SEIKA KAISHA, LTD. (JP) | 2002-09-17 | — | — | US | claimed |
| EP-1057818-A1 | PHENYLPIPERAZINE DERIVATIVES AS INTEGRIN ALPHAvBETA3 ANTAGONISTS | MEIJI SEIKA KAISHA LTD. (JP) | 2000-12-06 | — | — | EP | claimed |
| US-6451800-B1 | Phenylpiperazine derivatives as integrin αvβ3 antagonists | MEIJI SEIKA KAISHA, LTD. (JP) | 2002-09-17 | — | — | US | disclosed |
| EP-1057818-A1 | PHENYLPIPERAZINE DERIVATIVES AS INTEGRIN ALPHAvBETA3 ANTAGONISTS | MEIJI SEIKA KAISHA LTD. (JP) | 2000-12-06 | — | — | EP | disclosed |