Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 2/20 | 0.63 |
| ▸ | MMP8 | P22894 | 2/20 | 0.63 |
| ▸ | MMP2 | P08253 | 1/20 | 0.55 |
| ▸ | TACR1 | P25103 | 2/20 | 0.53 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.50 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.50 |
| ▸ | ITGAL | P20701 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | ECE1 | P42892 | 5/20 | 0.47 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8198377 | 1.00 | MMP9 (0.63) | MMP9MMP8MMP2TACR1ITGB2 | |
| SCHEMBL8850370 | 0.87 | MMP9 (0.80) | MMP9MMP8MMP2TACR1ACE | |
| SCHEMBL8201151 | 0.87 | MMP9 (0.80) | MMP9MMP8MMP2TACR1ACE | |
| SCHEMBL8201153 | 0.87 | MMP9 (0.80) | MMP9MMP8MMP2TACR1ACE | |
| SCHEMBL8488113 | 0.84 | MMP9 (0.51) | MMP9MMP8MMP2TACR1ITGB2 | |
| SCHEMBL8487186 | 0.83 | HTR2A (0.50) | MMP9MMP8MMP2TACR1ITGB2 | |
| SCHEMBL21292855 | 0.80 | HTR2A (0.61) | HTR2AHTR2CTSHRNR3C1 | |
| SCHEMBL20425196 | 0.80 | HTR2A (0.61) | HTR2AHTR2CTSHRNR3C1 | |
| SCHEMBL20242715 | 0.80 | HTR2A (0.61) | HTR2AHTR2CTSHRNR3C1 | |
| SCHEMBL8481429 | 0.78 | MMP9 (0.76) | MMP9MMP8MMP2TACR1ACE |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1000930-A2 | Tachykinin antagonists | WARNER-LAMBERT COMPANY (US) | 2000-05-17 | — | — | EP | claimed |
| EP-0655055-A1 | TACHYKININ ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1995-05-31 | — | — | EP | claimed |
| WO-1994004494-A1 | TACHYKININ ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1994-03-03 | — | — | WO | claimed |
| EP-1000930-A2 | Tachykinin antagonists | WARNER-LAMBERT COMPANY (US) | 2000-05-17 | — | — | EP | disclosed |
| US-5981755-A | Tachykinin antagonists | WARNER-LAMBERT COMPANY (US) | 1999-11-09 | — | — | US | disclosed |
| US-5594022-A | CARBAMATES | WARNER-LAMBERT COMPANY (US) | 1997-01-14 | — | — | US | disclosed |
| WO-1994004494-A1 | TACHYKININ ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1994-03-03 | — | — | WO | disclosed |