Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.37 |
| ▸ | CCR2 | P41597 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7344218 | 0.84 | HTT (0.46) | HTTL3MBTL1CCR2EPHX2GAA | |
| SCHEMBL7344242 | 0.79 | GPR139 (0.44) | HTTL3MBTL1GPR139SMN1; SMN2TAAR1 | |
| SCHEMBL7339304 | 0.77 | ITGB3 (0.45) | HTTL3MBTL1GPR139KMT2AMEN1 | |
| SCHEMBL27502755 | 0.75 | ITGB3 (0.41) | HTTL3MBTL1SMN1; SMN2TAAR1EPHX2 | |
| SCHEMBL7344443 | 0.75 | GPR139 (0.41) | HTTL3MBTL1GPR139CCR2SMN1; SMN2 | |
| SCHEMBL7347755 | 0.74 | ITGB3 (0.43) | GPR139GAA | |
| SCHEMBL6780118 | 0.74 | ITGB3 (0.47) | HTTL3MBTL1GPR139KMT2AMEN1 | |
| SCHEMBL7346999 | 0.73 | ITGB3 (0.52) | HTTL3MBTL1SMN1; SMN2GAAALDH1A1 | |
| SCHEMBL6779680 | 0.73 | GPR139 (0.45) | GPR139MAPK1KMT2AMEN1 | |
| SCHEMBL7347064 | 0.72 | GPR139 (0.46) | HTTL3MBTL1GPR139CCR2EPHX2 |
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-0850221-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1998-07-01 | — | — | EP | claimed |
| WO-1997008145-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1997-03-06 | — | — | WO | claimed |