Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9285160 | 0.94 | CYP3A4 (0.54) | TSHRCYP1A2CYP3A4TDP1KDM4E | |
| SCHEMBL39946 | 0.89 | ESR1 (0.44) | TSHRCYP1A2KDM4EMAPTALDH1A1 | |
| SCHEMBL9818045 | 0.89 | ESR1 (0.44) | TSHRCYP1A2KDM4EMAPTALDH1A1 | |
| Water SCHEMBL10786878 | 0.87 | ESR1 (0.43) | TSHRCYP1A2KDM4EMAPTALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL28398668 | 0.87 | ESR1 (0.43) | TSHRCYP1A2KDM4EMAPTALDH1A1 | |
| SCHEMBL4921797 | 0.85 | ALDH1A1 (0.43) | TSHRCYP1A2CYP3A4TDP1KDM4E | |
| SCHEMBL3265246 | 0.81 | ALDH1A1 (0.41) | TSHRCYP1A2CYP3A4KDM4EMAPT | |
| SCHEMBL3435243 | 0.79 | CHKA (0.41) | TSHRCYP1A2KDM4ECYP2C19ESR1 | |
| SCHEMBL2357793 | 0.79 | ESR1 (0.36) | TSHRCYP1A2CYP3A4TDP1KDM4E | |
| SCHEMBL4047348 | 0.78 | ESR1 (0.38) | TSHRCYP1A2KDM4EMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109689832-A | Heat transfer composition, method and system | 霍尼韦尔国际公司 | 2019-04-26 | — | — | CN | disclosed |