Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | RARA | P10276 | 1/20 | 0.36 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7970709 | 0.89 | RARB (0.39) | HNF4ACYP26A1CYP3A4RARARARB | |
| SCHEMBL7980612 | 0.86 | MCL1 (0.37) | HNF4ACYP26A1CYP3A4RARARARB | |
| SCHEMBL7595292 | 0.85 | FFAR1 (0.36) | OPRM1OPRD1OPRK1OPRL1FFAR1 | |
| SCHEMBL7988083 | 0.84 | RARB (0.38) | HNF4ACYP26A1CYP3A4RARARARB | |
| SCHEMBL7595289 | 0.82 | FFAR1 (0.38) | OPRM1OPRD1OPRK1OPRL1FFAR1 | |
| SCHEMBL5735140 | 0.81 | NR4A1 (0.49) | OPRM1OPRD1OPRK1OPRL1CYP26A1 | |
| SCHEMBL7984179 | 0.81 | RARB (0.36) | HNF4ACYP26A1CYP3A4RARARARB | |
| SCHEMBL5735372 | 0.80 | RARB (0.52) | CYP26A1CYP3A4RARARARBRARG | |
| SCHEMBL7554831 | 0.80 | OPRM1 (0.50) | HNF4AOPRM1OPRL1CYP26A1CYP3A4 | |
| SCHEMBL7982021 | 0.78 | HNF4A (0.38) | HNF4AOPRM1OPRL1CYP26A1CYP3A4 |
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-6303785-B1 | SUBSTITUTED N-CYCLOPROPYLTETRAHYDROISOQUINOLINES | ALLERGAN SALES, INC. | 2001-10-16 | — | — | US | disclosed |