Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 4/20 | 0.37 |
| ▸ | PYGL | P06737 | 4/20 | 0.36 |
| ▸ | PYGM | P11217 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.33 |
| ▸ | LGALS8 | O00214 | 1/20 | 0.33 |
| ▸ | LGALS3 | P17931 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4056416 | 0.86 | SMYD3 (0.39) | MCHR1SMYD3CYP51A1PYGLPYGM | |
| SCHEMBL19856858 | 0.85 | DRD2 (0.39) | MCHR1CYP51A1PYGLPYGMDRD2 | |
| SCHEMBL19856857 | 0.85 | DRD2 (0.39) | MCHR1CYP51A1PYGLPYGMDRD2 | |
| SCHEMBL4048476 | 0.84 | PYGL (0.41) | SMYD3CYP51A1PYGLPYGMMEN1 | |
| SCHEMBL8005445 | 0.84 | PYGL (0.39) | MCHR1SMYD3CYP51A1PYGLCNR1 | |
| SCHEMBL4052843 | 0.80 | PYGL (0.41) | SMYD3CYP51A1PYGLPYGMMEN1 | |
| SCHEMBL4051655 | 0.79 | PYGL (0.40) | SMYD3CYP51A1PYGLPYGMPLD1 | |
| SCHEMBL4050168 | 0.78 | DRD2 (0.36) | MCHR1CYP51A1PYGLPYGMDRD2 | |
| SCHEMBL4344872 | 0.76 | SMYD3 (0.37) | MCHR1SMYD3CYP51A1PYGLPYGM | |
| SCHEMBL19856948 | 0.75 | DRD2 (0.38) | MCHR1CYP51A1PYGLPYGMDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009111680-A1 | TRPV4 ANTAGONISTS | SMITHLINE BEECHAM CORPORATION (US) | 2009-09-11 | — | — | WO | disclosed |