Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20562373 | 0.84 | MAPT (0.39) | HTR1ASLC6A4CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5722666 | 0.82 | HTR2C (0.50) | HTR2AHTR2CHTR2BCYP3A4MAPT | |
| SCHEMBL10460364 | 0.80 | CXCR3 (0.33) | HTR2AHTR2CCXCR3 | |
| SCHEMBL8323266 | 0.78 | ERN1 (0.44) | CYP3A4CYP2D6CYP2C9CYP2C19MAPT | |
| SCHEMBL8133665 | 0.78 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C9CYP2C19MAPT | |
| SCHEMBL10459615 | 0.77 | ERN1 (0.32) | ERN1CXCR3 | |
| SCHEMBL10459591 | 0.77 | HTR2A (0.33) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL30665872 | 0.76 | HTR2A (0.50) | HTR2AHTR2CHTR2BERN1 | |
| SCHEMBL26654718 | 0.76 | HTR2A (0.50) | HTR2AHTR2CHTR2BERN1 | |
| SCHEMBL10459600 | 0.74 | CLK1 (0.43) | CYP3A4CYP2D6CYP2C9CYP2C19MAPT |
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-4966907-A | ANTIINFLAMMATORY AGENT, ANTIALLERGENS | MERCK & CO., INC. (US) | 1990-10-30 | — | — | US | disclosed |