Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 9/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31507371 | 0.79 | NPC1 (0.47) | ALDH1A1GPR84SMN1; SMN2LMNANPC1 | |
| SCHEMBL9261448 | 0.74 | ALDH1A1 (0.42) | ALDH1A1GPR84SMN1; SMN2CXCR2USP2 | |
| SCHEMBL9264650 | 0.73 | RAB9A (0.52) | ALDH1A1SMN1; SMN2LMNANPC1MAPK1 | |
| SCHEMBL423629 | 0.71 | RAB9A (0.49) | ALDH1A1SMN1; SMN2LMNANPC1MAPK1 | |
| SCHEMBL7432905 | 0.71 | RAB9A (0.46) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL9381449 | 0.70 | SLC6A3 (0.45) | ALDH1A1GPR84 | |
| SCHEMBL10427482 | 0.70 | ALDH1A1 (0.51) | ALDH1A1GPR84SMN1; SMN2CXCR2MAPK1 | |
| SCHEMBL10466181 | 0.69 | NPC1 (0.54) | ALDH1A1GPR84LMNANPC1MAPK1 | |
| SCHEMBL28029458 | 0.67 | HTR7 (0.59) | ALDH1A1GPR84SMN1; SMN2CXCR2LMNA | |
| SCHEMBL9777349 | 0.67 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2CXCR2LMNANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5464865-A | Enzyme inhibitors as antiinflammatory agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1995-11-07 | — | — | US | disclosed |