Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | STS | P08842 | 1/20 | 0.37 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | SFRP1 | Q8N474 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5847589 | 0.98 | HTR2A (0.53) | HTR2AHTR2CHTR2BGPR119TACR1 | |
| SCHEMBL5848926 | 0.92 | HTR2A (0.50) | HTR2AHTR2CHTR2BGPR119NPC1 | |
| SCHEMBL5847206 | 0.91 | HTR2A (0.42) | HTR2AHTR2CHTR2BGPR119TACR1 | |
| SCHEMBL5847212 | 0.91 | HTR2A (0.63) | HTR2AHTR2CHTR2BGPR119STS | |
| SCHEMBL5846925 | 0.90 | HTR2A (0.47) | HTR2AHTR2CHTR2BGPR119TACR1 | |
| SCHEMBL5849629 | 0.90 | HTR2A (0.53) | HTR2AHTR2CHTR2BGPR119NPC1 | |
| SCHEMBL5847802 | 0.89 | HTR2A (0.53) | HTR2AHTR2CHTR2BGPR119TACR1 | |
| SCHEMBL5848017 | 0.89 | HTR2A (0.45) | HTR2AHTR2CHTR2BGPR119TACR1 | |
| SCHEMBL5846988 | 0.89 | HTR2A (0.47) | HTR2AHTR2CHTR2BGPR119NPC1 | |
| SCHEMBL5416111 | 0.88 | HTR2A (0.50) | HTR2AHTR2CHTR2BDRD2 |
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-7081455-B2 | Substituted heterocycle fused gamma-carbolines | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-07-25 | — | — | US | disclosed |