Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8601998 | 0.87 | TSHR (0.47) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL11417443 | 0.86 | TSHR (0.50) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL8600740 | 0.86 | TSHR (0.55) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL11414684 | 0.85 | TSHR (0.57) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL11663143 | 0.81 | TSHR (0.53) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL14836356 | 0.81 | TSHR (0.53) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL8600737 | 0.80 | TSHR (0.48) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL28673768 | 0.80 | FAAH (0.53) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL28001044 | 0.79 | ALDH1A1 (0.47) | TSHRCYP3A4ATMTDP1ALDH1A1 | |
| SCHEMBL19125886 | 0.79 | FAAH (0.56) | TSHRCYP3A4ATMTDP1ALDH1A1 |
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-5798331-A | AGROCHEMICAL FORMULATIONS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1998-08-25 | — | — | US | disclosed |