Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 10/20 | 0.50 |
| ▸ | HTR2A | P28223 | 8/20 | 0.40 |
| ▸ | HTR2B | P41595 | 8/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1622212 | 0.86 | CNR1 (0.43) | HTR2CHTR2AHTR2BMEN1POLB | |
| SCHEMBL3669615 | 0.83 | HTR2C (0.49) | HTR2CHTR2AHTR2BHTR6ALDH1A1 | |
| SCHEMBL1622906 | 0.77 | HTR2C (0.77) | HTR2CHTR2AHTR2BHTR6 | |
| SCHEMBL3669330 | 0.74 | HTR2C (0.52) | HTR2CALDH1A1KDM4ELMNAHTT | |
| SCHEMBL14043604 | 0.71 | PTGDR2 (0.39) | HTR2CHTR2AHTR2BPTGDR2MAPK1 | |
| SCHEMBL1622444 | 0.71 | CNR1 (0.42) | HTR2CHTR2AHTR2BPOLBCNR2 | |
| SCHEMBL183306 | 0.70 | HTR2A (0.53) | HTR2CHTR2AHTR2BCNR2 | |
| SCHEMBL1621309 | 0.70 | HTR2C (0.42) | HTR2CHTR2ACNR2TP53 | |
| SCHEMBL17317715 | 0.70 | KCNK3 (0.46) | ENPP2 | |
| SCHEMBL1622909 | 0.69 | CNR1 (0.39) | MEN1KMT2ACNR2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2139896-A1 | PYRIMIDO [4, 5-D]AZEPINE DERIVATIVES AS 5-HT2C AGONISTS | Pfizer Limited (GB) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008117169-A1 | PYRIMIDO [4, 5-D] AZEPINE DERIVATIVES AS 5-HT2C AGONISTS | PFIZER LIMITED (GB) | 2008-10-02 | — | — | WO | disclosed |