Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8922245 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL8917747 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL877094 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL27236467 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL8922244 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL13476222 | 0.79 | ALDH1A1 (0.56) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| Hydrochloric Acid SCHEMBL514640 | 0.78 | KAT2B (0.57) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL16143752 | 0.78 | ALDH1A1 (0.51) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL837892 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TDP1HPGDPOLBKAT2B | |
| SCHEMBL13476249 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TDP1HPGDPOLBKAT2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5668136-A | ANTIARTERIOSCLEROTIC AGENT, CHOLESTEROL O-ACYLTRANSFERASE INHIBITOR | EISAI CO., LTD. (JP) | 1997-09-16 | — | — | US | disclosed |
| EP-0477778-B1 | Benzene, pyridine and pyrimidine derivative | EISAI CO LTD (JP) | 1996-04-24 | — | — | EP | disclosed |
| EP-0615970-A1 | Benzene, pyridine and pyrimidine derivative | Eisai Co., Ltd. (JP) | 1994-09-21 | — | — | EP | disclosed |
| EP-0477778-A2 | Benzene, pyridine and pyrimidine derivative | Eisai Co., Ltd. (JP) | 1992-04-01 | — | — | EP | disclosed |