Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | GPR17 | Q13304 | 2/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL115272 | 0.81 | HPGD (0.55) | NPSR1FFAR1FFAR4ALDH1A1HPGD | |
| SCHEMBL32689799 | 0.81 | FFAR1 (0.49) | PLAUHDAC6NPSR1FFAR1GPR17 | |
| SCHEMBL29957277 | 0.81 | KEAP1 (0.50) | ALDH1A1HPGDHSD17B10CYP3A4ALOX15 | |
| SCHEMBL4699761 | 0.81 | FFAR1 (0.49) | PLAUHDAC6NPSR1FFAR1GPR17 | |
| SCHEMBL6950315 | 0.81 | KEAP1 (0.50) | ALDH1A1HPGDHSD17B10CYP3A4ALOX15 | |
| SCHEMBL1418003 | 0.81 | HIF1A (0.59) | PLAUHDAC6NPSR1FFAR1GPR17 | |
| SCHEMBL11413993 | 0.80 | FFAR1 (0.50) | NPSR1FFAR1FFAR4ALDH1A1HPGD | |
| SCHEMBL14430375 | 0.80 | FFAR1 (0.54) | PLAUHDAC6NPSR1FFAR1GPR17 | |
| Hydrochloric Acid SCHEMBL3051856 | 0.79 | PLAU (0.44) | PLAUHDAC6NPSR1FFAR1GPR17 | |
| SCHEMBL9309798 | 0.79 | FFAR1 (0.47) | PLAUHDAC6NPSR1FFAR1GPR17 |
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-2007070826-A1 | ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-06-21 | — | — | WO | disclosed |