Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.34 |
| ▸ | MC5R | P33032 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7737867 | 0.85 | CYP19A1 (0.56) | CYP19A1CYP2D6 | |
| SCHEMBL8198238 | 0.68 | HTR2A (0.58) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 | |
| SCHEMBL12706097 | 0.67 | HTR2A (0.62) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 | |
| SCHEMBL323473 | 0.65 | HTR2A (0.50) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 | |
| SCHEMBL27709549 | 0.63 | CYP19A1 (0.52) | CYP19A1 | |
| SCHEMBL3677922 | 0.63 | HTR2A (0.71) | HTR2AHTR2CHTR2BCYP1A2CYP2A6 | |
| SCHEMBL4197804 | 0.63 | HTR2A (0.60) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 | |
| SCHEMBL27699913 | 0.63 | HTR2A (0.60) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 | |
| SCHEMBL17892066 | 0.61 | MEN1 (0.50) | SLC6A4CYP1A2CYP2A6CYP3A4CYP2D6 | |
| SCHEMBL1127612 | 0.61 | HTR2A (0.53) | HTR2AHTR2CHTR2BSLC6A4CYP1A2 |
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-RE37781-E1 | VIRICIDES, PROTEASE INHIBITOR | DUPONT PHARMACEUTICALS COMPANY | 2002-07-02 | — | — | US | disclosed |