Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9729507 | 1.00 | IDO1 (0.42) | IDO1ALDH1A1CDK9NAPRTGAA | |
| SCHEMBL9729571 | 1.00 | IDO1 (0.42) | IDO1ALDH1A1CDK9NAPRTGAA | |
| SCHEMBL9729554 | 0.88 | IDO1 (0.42) | IDO1ALDH1A1CDK9GAA | |
| SCHEMBL9730160 | 0.85 | IDO1 (0.44) | IDO1ALDH1A1NAPRTGAAKDM4E | |
| SCHEMBL29586383 | 0.79 | RAB9A (0.47) | IDO1ALDH1A1GAACHRNB2CHRNA4 | |
| SCHEMBL22696 | 0.79 | RAB9A (0.47) | IDO1ALDH1A1GAACHRNB2CHRNA4 | |
| SCHEMBL22695 | 0.79 | RAB9A (0.47) | IDO1ALDH1A1GAACHRNB2CHRNA4 | |
| SCHEMBL30697719 | 0.79 | RAB9A (0.47) | IDO1ALDH1A1GAACHRNB2CHRNA4 | |
| SCHEMBL3066779 | 0.79 | RAB9A (0.47) | IDO1ALDH1A1GAACHRNB2CHRNA4 | |
| SCHEMBL9730033 | 0.78 | CYP11B2 (0.41) | IDO1ALDH1A1CYP11B2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5171354-A | Herbicides | CIBA-GEIGY CORPORATION (US) | 1992-12-15 | — | — | US | disclosed |
| EP-0445069-A1 | Heterocyclic compounds | CIBA-GEIGY AG (CH) | 1991-09-04 | — | — | EP | disclosed |