Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | SCN1A | P35498 | 2/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 4/20 | 0.48 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11712203 | 0.96 | THRA (0.55) | THRATHRBCYP1A2CYP2D6SCN1A | |
| SCHEMBL11714059 | 0.95 | THRA (0.57) | THRATHRBCYP1A2CYP2D6SCN1A | |
| SCHEMBL11715756 | 0.93 | BCHE (0.51) | THRATHRBCYP1A2CYP2D6SCN1A | |
| SCHEMBL11718751 | 0.91 | BCHE (0.52) | THRATHRBCYP1A2CYP2D6SCN1A | |
| SCHEMBL11715650 | 0.90 | BCHE (0.53) | THRATHRBBCHEACHE | |
| SCHEMBL11713184 | 0.90 | THRB (0.48) | THRATHRBCYP1A2CYP2D6SCN1A | |
| SCHEMBL11716908 | 0.89 | SIGMAR1 (0.56) | CYP1A2CYP2D6SCN1ASLC6A3KCNH2 | |
| SCHEMBL11717604 | 0.88 | BCHE (0.59) | CYP1A2CYP2D6SCN1ASLC6A3KCNH2 | |
| SCHEMBL11719494 | 0.86 | BCHE (0.58) | CYP1A2CYP2D6SCN1ASLC6A3KCNH2 | |
| SCHEMBL11717138 | 0.86 | THRA (0.49) | THRATHRBCYP1A2CYP2D6SCN1A |
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 |