Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18317035 | 0.89 | MEN1 (0.41) | MAPTKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL9383680 | 0.85 | NPC1 (0.41) | MAPTKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL9724282 | 0.81 | KMT2A (0.57) | MAPTKDM4ECYP3A4ALDH1A1LMNA | |
| SCHEMBL16930401 | 0.79 | NPC1 (0.43) | MAPTKDM4ECYP2C19CYP3A4LMNA | |
| SCHEMBL16930398 | 0.77 | NPC1 (0.44) | MAPTKDM4ELMNASMN1; SMN2GLA | |
| SCHEMBL16984472 | 0.77 | KDM4E (0.55) | MAPTKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL18325645 | 0.77 | NPC1 (0.45) | MAPTKDM4EALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL18317027 | 0.77 | MEN1 (0.41) | MAPTKDM4EALDH1A1LMNAHPGD | |
| SCHEMBL18317003 | 0.76 | MEN1 (0.43) | MAPTKDM4EALDH1A1LMNAHPGD | |
| Acetic Acid SCHEMBL9849558 | 0.76 | KDM4E (0.54) | MAPTKDM4EALDH1A1LMNAHPGD |
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-5112837-A | Inhibitors of thymidylate synthetase enzyme | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-12 | — | — | US | disclosed |
| EP-0318225-A2 | 6-Aryl aminomethyl quinoline derivatives and their use as anti-tumour agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |