Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
| ▸ | EBP | Q15125 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3653309 | 0.79 | ESR1 (0.54) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL15028666 | 0.77 | ESR1 (0.50) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL15028586 | 0.77 | ESR1 (0.50) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL3847255 | 0.77 | ESR1 (0.52) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL7623247 | 0.76 | ESR1 (0.75) | ESR1EBPSIGMAR1MIFCYP26A1 | |
| SCHEMBL3141978 | 0.76 | MPO (0.54) | KDM4ESMN1; SMN2ALDH1A1GLAMPO | |
| SCHEMBL3655152 | 0.75 | ESR1 (0.50) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL3656979 | 0.75 | ESR1 (0.65) | ESR1EBPSIGMAR1MPOMIF | |
| SCHEMBL9516545 | 0.74 | MIF (0.45) | KDM4ESMN1; SMN2ALDH1A1HPGDESR1 | |
| SCHEMBL9516552 | 0.74 | EGFR (0.50) | KDM4EALDH1A1ESR1GLAEBP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0281283-B1 | HETEROCYCLIC COMPOUNDS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-02-10 | — | — | EP | disclosed |
| US-4910212-A | Containing 1,2,4-triazole or imidazole ring | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-03-20 | — | — | US | disclosed |
| EP-0281283-A1 | Heterocyclic compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-09-07 | — | — | EP | disclosed |