Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 5/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HK1 | P19367 | 1/20 | 0.40 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL27490347 | 0.78 | TLR8 (0.51) | CYP2A6ALDH1A1CYP2A13CYP11B1CYP11B2 | |
| SCHEMBL5209764 | 0.72 | CYP2A6 (0.67) | CYP2A6ALDH1A1CYP11B1CYP11B2CYP2C9 | |
| SCHEMBL1133225 | 0.71 | CYP2A6 (0.62) | CYP2A6ALDH1A1CYP2A13IDO1CYP2C9 | |
| SCHEMBL31627317 | 0.71 | CYP2A6 (0.62) | CYP2A6ALDH1A1CYP2A13IDO1CYP2C9 | |
| SCHEMBL5208549 | 0.68 | CYP2A6 (0.63) | CYP2A6ALDH1A1CYP11B1CYP11B2CYP2C9 | |
| SCHEMBL5201713 | 0.67 | CYP2A6 (0.62) | CYP2A6CYP11B1CYP11B2CYP2C9CYP2C19 | |
| SCHEMBL2384628 | 0.66 | MKNK1 (0.57) | CYP2A6ALDH1A1CYP11B2CYP2C9CYP2C19 | |
| SCHEMBL7260734 | 0.66 | CYP11B1 (0.54) | ALDH1A1CYP11B1CYP11B2IDO1HPGDS | |
| SCHEMBL7973153 | 0.65 | CYP11B1 (0.58) | CYP2A6ALDH1A1CYP11B1CYP11B2IDO1 | |
| SCHEMBL1502108 | 0.65 | CYP11B1 (0.62) | CYP11B1CYP11B2IDO1CYP3A4CYP2D6 |
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-6498146-B1 | Erythromycin derivatives | PFIZER INC | 2002-12-24 | — | — | US | disclosed |