Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 6/20 | 0.46 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL350342 | 0.78 | TSHR (0.55) | TSHRDPP4F2HTR2ATAAR1 | |
| SCHEMBL29263811 | 0.78 | TSHR (0.55) | TSHRDPP4F2HTR2ATAAR1 | |
| SCHEMBL6919378 | 0.74 | TSHR (0.50) | TSHRDPP4F2HTR2ATAAR1 | |
| SCHEMBL4414443 | 0.72 | MTOR (0.52) | TSHRAOC3DPP4F2CTSD | |
| Hydrochloric Acid SCHEMBL27833054 | 0.72 | TSHR (0.48) | TSHRAOC3DPP4F2LMNA | |
| Hydrochloric Acid SCHEMBL10521667 | 0.72 | KMT2A (0.48) | TSHRHTR2ATAAR1LMNACYP3A4 | |
| SCHEMBL17660991 | 0.72 | AOC3 (0.45) | TSHRAOC3DPP4F2CTSD | |
| Hydrochloric Acid SCHEMBL10786964 | 0.70 | CYP3A4 (0.54) | TSHRAOC3DPP4F2CTSD | |
| SCHEMBL27701035 | 0.70 | DPP4 (0.52) | AOC3DPP4F2CTSDHTR2A | |
| SCHEMBL7428062 | 0.70 | ALDH1A1 (0.43) | TSHRDPP4F2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103012302-A | Production process of clofentezine | NANTONG BAOYE CHEMICAL CO LTD | 2013-04-03 | — | — | CN | disclosed |
| WO-1996012706-A1 | NOVEL ACID PYRAZOLE AND PYRAZOLONE DERIVATIVES FOR USE AS ENDOTHELIN RECEPTOR ANTAGONISTS | ROUSSEL UCLAF (FR) | 1996-05-02 | — | — | WO | disclosed |