Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 9/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.35 |
| ▸ | CDK9 | P50750 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5848229 | 0.94 | NPC1 (0.40) | PDE4BNPC1ALDH1A1MAPTMAPK1 | |
| SCHEMBL5418618 | 0.89 | CCR3 (0.39) | PDE4BCCR3HTR2AHTR2CHTR2B | |
| SCHEMBL5418614 | 0.89 | CCR3 (0.39) | PDE4BCCR3HTR2AHTR2CHTR2B | |
| SCHEMBL5635435 | 0.85 | PDE4B (0.39) | PDE4BNPC1ALDH1A1MAPTMAPK1 | |
| SCHEMBL5847917 | 0.85 | HTR2A (0.46) | PDE4BALDH1A1MAPTHTTMEN1 | |
| SCHEMBL5847910 | 0.85 | PIK3CD (0.49) | PDE4BPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL5846970 | 0.84 | HTR2A (0.43) | ALDH1A1HTTMEN1KMT2AGPR119 | |
| SCHEMBL5420299 | 0.83 | CCR3 (0.39) | ALDH1A1CCR3HTR2AHTR2CHTR2B | |
| SCHEMBL5420302 | 0.83 | CCR3 (0.39) | ALDH1A1CCR3HTR2AHTR2CHTR2B | |
| SCHEMBL5849353 | 0.81 | GPR119 (0.37) | PDE4BPIK3CDPIK3CAPIK3CBPIK3CG |
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 |
|---|---|---|---|---|---|---|---|
| US-7081455-B2 | Substituted heterocycle fused gamma-carbolines | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-07-25 | — | — | US | claimed |
| US-7081455-B2 | Substituted heterocycle fused gamma-carbolines | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-07-25 | — | — | US | disclosed |