Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | CRACR2A | Q9BSW2 | 3/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL1027062 | 0.82 | DHODH (0.44) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL9638659 | 0.82 | LMNA (0.56) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL14648620 | 0.81 | DHODH (0.43) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL9639001 | 0.81 | LMNA (0.62) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL27513121 | 0.80 | DHODH (0.46) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL10424090 | 0.79 | DHODH (0.41) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL3067139 | 0.77 | DHODH (0.43) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL8941898 | 0.75 | DHODH (0.41) | DHODHLMNANAALAD2TAS1R3TAS1R1 | |
| SCHEMBL27606823 | 0.74 | CYP2C8 (0.42) | DHODHLMNANPC1CYP3A4CYP2C9 | |
| SCHEMBL8045714 | 0.73 | RAB9A (0.47) | DHODHLMNACRACR2ANPC1GMNN |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4935434-A | Antiarthritic isoxazole-4-carboxamides | BRISTOL-MYERS COMPANY (US) | 1990-06-19 | — | — | US | claimed |
| EP-0326108-A1 | Antiarthritic isoxazole-4-carboxamides | Bristol-Myers Company (US) | 1989-08-02 | — | — | EP | claimed |
| EP-0326107-B1 | ANTIARTHRITIC BETA-CYCLOALKYL-BETA-OXOPROPIONITRILES | Bristol-Myers Squibb Company (US) | 1992-09-02 | — | — | EP | disclosed |
| US-4935434-A | Antiarthritic isoxazole-4-carboxamides | BRISTOL-MYERS COMPANY (US) | 1990-06-19 | — | — | US | disclosed |
| US-4888357-A | ANTIINFLAMMATORY AGENTS | BRISTOL-MYERS COMPANY (US) | 1989-12-19 | — | — | US | disclosed |
| EP-0326107-A1 | Antiarthritic beta-cycloalkyl-beta-oxopropionitriles | Bristol-Myers Squibb Company (US) | 1989-08-02 | — | — | EP | disclosed |