Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.51 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PAM | P19021 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1196446 | 0.93 | CYP4F2 (0.58) | CYP4F2CYP4A11HSP90AB1KDM4EALDH1A1 | |
| SCHEMBL4104271 | 0.87 | CYP4F2 (0.66) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| SCHEMBL238714 | 0.84 | AKR1B1 (0.61) | AKR1B1KDM4EPOLBALDH1A1GAA | |
| Water SCHEMBL27293689 | 0.79 | ALDH1A1 (0.61) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| SCHEMBL7996038 | 0.79 | CYP4F2 (0.56) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| SCHEMBL4113212 | 0.78 | CYP4F2 (0.76) | CYP4F2CYP4A11HSP90AB1KDM4EALDH1A1 | |
| SCHEMBL1870609 | 0.77 | ALDH1A1 (0.62) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| Benzene SCHEMBL28096336 | 0.77 | ALDH1A1 (0.62) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| SCHEMBL4675 | 0.77 | ALDH1A1 (0.62) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E | |
| SCHEMBL1560308 | 0.76 | SLC7A5 (0.65) | CYP4F2CYP4A11HSP90AB1AKR1B1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1438310-B1 | BETA-CARBOLIN DERIVATIVES AS PTP-INHIBITORS | TRANSTECH PHARMA INC (US) | 2006-12-20 | — | — | EP | claimed |