Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | SCN1A | P35498 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.48 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.48 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11713999 | 0.97 | THRA (0.51) | THRATHRBESR1LMNACYP1A2 | |
| SCHEMBL11713184 | 0.97 | THRB (0.48) | THRATHRBESR1LMNACYP1A2 | |
| SCHEMBL11716788 | 0.95 | ESR1 (0.48) | THRATHRBESR1LMNASMPD1 | |
| SCHEMBL11720224 | 0.92 | KMT2A (0.49) | THRATHRBESR1LMNASMPD1 | |
| SCHEMBL11720978 | 0.92 | ESR1 (0.58) | ESR1LMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL11712256 | 0.89 | KMT2A (0.48) | THRATHRBESR1LMNACYP1A2 | |
| SCHEMBL11712203 | 0.89 | THRA (0.55) | THRATHRBLMNACYP1A2CHRM2 | |
| SCHEMBL11717402 | 0.88 | ESR1 (0.54) | THRATHRBESR1KMT2ABCHE | |
| SCHEMBL11720078 | 0.87 | ESR1 (0.55) | THRATHRBESR1LMNACYP3A4 | |
| SCHEMBL11719732 | 0.86 | THRA (0.54) | THRATHRBLMNACYP1A2CHRM2 |
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-4010272-A | ANTHELMINTICALLY ACTIVE BASICALLY SUBSTITUTED 2-CARBALKOXY-AMINO-BENZIMIDAZOLYL-5(6)-PHENYL ETHERS AND -KETONES | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-03-01 | — | — | US | disclosed |