Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SRC | P12931 | 2/20 | 0.37 |
| ▸ | STS | P08842 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CCR3 | P51677 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5847291 | 0.98 | HTR2A (0.49) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5848103 | 0.90 | HTR2A (0.49) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5410553 | 0.90 | HTR2C (0.48) | HTR2AHTR2CHTR2BALDH1A1KDM4E | |
| SCHEMBL5847743 | 0.89 | HTR2A (0.48) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5847431 | 0.89 | HTR2A (0.50) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5848505 | 0.89 | HTR2A (0.48) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5849267 | 0.89 | HTR2A (0.39) | HTR2AHTR2CHTR2BGPR119 | |
| SCHEMBL5847212 | 0.88 | HTR2A (0.63) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5848188 | 0.88 | HTR2A (0.50) | HTR2AHTR2CHTR2BGPR119EPHX2 | |
| SCHEMBL5847313 | 0.87 | HTR2A (0.51) | HTR2AHTR2CHTR2BGPR119EPHX2 |
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 |