Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.35 |
| ▸ | CHRNG | P07510 | 2/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CHRND | Q07001 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8904276 | 0.88 | PTGS1 (0.38) | LMNAPOLBHPGDSLC6A2CHRNA1 | |
| SCHEMBL8905900 | 0.86 | LMNA (0.37) | CYP3A4NPC1AKR1B1LMNAPOLB | |
| SCHEMBL8904850 | 0.86 | ALDH1A1 (0.40) | CYP3A4AKR1B1LMNAPOLBHPGD | |
| SCHEMBL8904085 | 0.82 | NPC1 (0.39) | NPC1RAB9ALMNAPOLBHPGD | |
| SCHEMBL8906156 | 0.81 | ALDH1A1 (0.35) | NPC1RAB9ALMNAPOLBHPGD | |
| SCHEMBL9030270 | 0.81 | PDE3B (0.42) | CYP3A4NPC1RAB9ALMNAHPGD | |
| SCHEMBL9030683 | 0.80 | KMT2A (0.35) | AKR1B1LMNAPOLBHPGDKMT2A | |
| SCHEMBL8904194 | 0.79 | CCNA2 (0.38) | CYP3A4ALOX15RAB9AAKR1B1LMNA | |
| SCHEMBL8905938 | 0.79 | MEN1 (0.38) | CYP3A4ALOX15NPC1AKR1B1LMNA | |
| SCHEMBL8904574 | 0.77 | NPC1 (0.42) | NPC1RAB9ALMNAPOLBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5622948-A | ANALGESICS | SYNTEX (U.S.A.) INC. (US) | 1997-04-22 | — | — | US | disclosed |