Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.41 |
| ▸ | ITGAL | P20701 | 5/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6532940 | 1.00 | NPC1 (0.47) | NPC1RAB9AMAOBPOLBCAPN1 | |
| SCHEMBL6497505 | 0.89 | NPC1 (0.47) | NPC1RAB9AMAOBPOLBCAPN1 | |
| SCHEMBL6503994 | 0.83 | CAPN1 (0.45) | NPC1RAB9ACAPN1ITGALITGB2 | |
| SCHEMBL6497738 | 0.83 | RAB9A (0.53) | NPC1RAB9ACAPN1ITGALITGB2 | |
| SCHEMBL6497734 | 0.83 | RAB9A (0.53) | NPC1RAB9ACAPN1ITGALITGB2 | |
| SCHEMBL6503990 | 0.83 | CAPN1 (0.45) | NPC1RAB9ACAPN1ITGALITGB2 | |
| SCHEMBL6503421 | 0.82 | ITGAL (0.48) | NPC1RAB9APOLBCAPN1ITGAL | |
| SCHEMBL8296029 | 0.82 | ITGAL (0.48) | NPC1RAB9APOLBCAPN1ITGAL | |
| SCHEMBL6503425 | 0.82 | ITGAL (0.48) | NPC1RAB9APOLBCAPN1ITGAL | |
| SCHEMBL6497639 | 0.82 | CAPN1 (0.42) | NPC1RAB9APOLBCAPN1ITGAL |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |