Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HMGCR | P04035 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11672445 | 0.86 | TSHR (0.53) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| SCHEMBL8601094 | 0.80 | TSHR (0.47) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| SCHEMBL10496051 | 0.80 | TSHR (0.47) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| SCHEMBL9848546 | 0.78 | TSHR (0.44) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| SCHEMBL9619717 | 0.75 | ALDH1A1 (0.42) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| SCHEMBL28256788 | 0.75 | TSHR (0.42) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| Dalapon SCHEMBL45164 | 0.74 | — | — | |
| SCHEMBL301323 | 0.74 | — | — | |
| SCHEMBL1678472 | 0.74 | TSHR (0.57) | TSHRALDH1A1TP53CYP2D6CYP2C19 | |
| Dalapon SCHEMBL4895986 | 0.74 | TSHR (0.57) | TSHRALDH1A1TP53CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114276244-B | Preparation method of carboxylic acid compound and metal salt derivative thereof | 苏州汉酶生物技术有限公司 | 2024-02-27 | — | — | CN | disclosed |
| US-5571793-A | COMBATTING ENDOPARASITES IN HUMANS OR ANIMALS BY ADMINISTERING PEPTIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-11-05 | — | — | US | disclosed |
| US-5529984-A | NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-06-25 | — | — | US | disclosed |
| US-5525591-A | HUMAN OR VETERINARY MEDICINE | BAYER AKTIENGESELLSCHAFT (DE) | 1996-06-11 | — | — | US | disclosed |