Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.50 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8602693 | 0.94 | S1PR1 (0.43) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL4780628 | 0.94 | S1PR1 (0.43) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL4732559 | 0.89 | POLB (0.42) | S1PR1S1PR3S1PR5MEN1MAPT | |
| SCHEMBL3345264 | 0.87 | POLB (0.39) | TP53MAPTKMT2A | |
| SCHEMBL1651679 | 0.87 | POLB (0.39) | TP53MAPTKMT2A | |
| SCHEMBL17627001 | 0.86 | S1PR1 (0.51) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL5509941 | 0.86 | S1PR1 (0.51) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL27650964 | 0.86 | S1PR1 (0.51) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL28131709 | 0.84 | S1PR1 (0.49) | S1PR1S1PR3S1PR5MEN1TP53 | |
| SCHEMBL7479850 | 0.83 | MEN1 (0.40) | MEN1TP53CYP1A2CYP2D6MAPT |
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-2002006229-A2 | HETEROCYCLIC BETA-3 ADRENERGIC RECEPTOR AGONISTS | WYETH (US) | 2002-01-24 | — | — | WO | disclosed |