Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL1002011 | 0.84 | HTR2C (0.41) | HTR2CNPC1 | |
| SCHEMBL21523837 | 0.78 | CHRNB2 (0.48) | HTR2AHTR2CHTR2BTAAR1KDM1A | |
| SCHEMBL5562198 | 0.76 | CA1 (0.40) | HTR2AHTR2CHTR2BTAAR1KDM1A | |
| SCHEMBL29698914 | 0.76 | CA1 (0.40) | HTR2AHTR2CHTR2BTAAR1KDM1A | |
| SCHEMBL5562192 | 0.76 | CA1 (0.40) | HTR2AHTR2CHTR2BTAAR1KDM1A | |
| SCHEMBL27660071 | 0.75 | CYP3A4 (0.44) | CA1CYP19A1KDM4E | |
| SCHEMBL27594648 | 0.75 | DRD2 (0.49) | HTR2AHTR2CHTR2B | |
| SCHEMBL10153626 | 0.74 | MAP4K1 (0.44) | HTR2AHTR2CHTR2BKDM1ARCOR1 | |
| Hydrochloric Acid SCHEMBL27749956 | 0.73 | DDB1 (0.42) | HTR2CCA1KDM4E | |
| SCHEMBL433220 | 0.73 | CHRNB2 (0.53) | SMN1; SMN2CA1 |
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-105189493-A | Novel Pyrazole Derivatives | MOCHIDA PHARM CO LTD | 2015-12-23 | — | — | CN | disclosed |