Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9651998 | 0.90 | RAB9A (0.46) | RAB9ACYP3A4CYP2C9POLBTSHR | |
| SCHEMBL9496544 | 0.83 | POLB (0.51) | CYP3A4CYP2C9POLBHPGDABCB1 | |
| SCHEMBL8180270 | 0.80 | POLB (0.68) | RAB9ACYP3A4CYP2C9POLBNPC1 | |
| SCHEMBL9714560 | 0.79 | POLB (0.70) | CYP3A4CYP2C9POLBABCB1 | |
| SCHEMBL9651954 | 0.78 | NPC1 (0.58) | RAB9ACYP3A4CYP2C9POLBHPGD | |
| SCHEMBL9651981 | 0.78 | ABCB1 (0.69) | CYP3A4CYP2C9POLBABCB1ALDH1A1 | |
| SCHEMBL10718940 | 0.77 | CYP3A4 (0.56) | CYP3A4CYP2C9POLBABCB1 | |
| SCHEMBL9651937 | 0.77 | RAB9A (0.57) | RAB9ACYP3A4CYP2C9POLBNPC1 | |
| SCHEMBL8172543 | 0.75 | POLB (0.68) | RAB9ACYP3A4CYP2C9POLBTSHR | |
| SCHEMBL10747617 | 0.74 | ABCB1 (0.46) | ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0261755-B1 | FIVE-MEMBERED HETEROCYCLIC DERIVATIVES OF N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1992-12-16 | — | — | EP | disclosed |