Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.55 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.53 |
| ▸ | MC4R | P32245 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | CCR3 | P51677 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL20571573 | 0.83 | CYP3A4 (0.59) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL1994180 | 0.81 | SIGMAR1 (0.61) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL20571837 | 0.81 | OPRL1 (0.54) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL10509216 | 0.80 | CYP2D6 (0.54) | CYP3A4HSD17B10SIGMAR1OPRL1POLB | |
| Hydrochloric Acid SCHEMBL15608841 | 0.79 | CYP3A4 (0.59) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| Methane SCHEMBL4247840 | 0.79 | SIGMAR1 (0.63) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL22050089 | 0.79 | OPRL1 (0.55) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL1992310 | 0.78 | CYP3A4 (0.57) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL1586467 | 0.78 | OPRL1 (0.58) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R | |
| SCHEMBL24315818 | 0.78 | CYP3A4 (0.53) | CYP3A4HSD17B10SIGMAR1OPRL1MC4R |
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-5132311-A | Prolonging cardiac action potential repolarization | G. D. SEARLE & CO. (US) | 1992-07-21 | — | — | US | disclosed |