Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 8/20 | 0.46 |
| ▸ | VNN1 | O95497 | 1/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8646691 | 0.88 | CYP1A1 (0.47) | NAMPTF10CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL8650927 | 0.86 | NPC1 (0.45) | NAMPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL8646693 | 0.85 | CYP1A1 (0.42) | NAMPTF10CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL8646754 | 0.85 | CYP1A1 (0.52) | NAMPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL8644166 | 0.84 | CYP1A1 (0.52) | F10CYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL8647943 | 0.83 | CYP1A2 (0.47) | NAMPTCYP1A1CYP1A2CYP1B1CYP3A4 | |
| SCHEMBL8646756 | 0.83 | CYP3A4 (0.48) | F10AKR1C3CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL8650918 | 0.82 | AKR1C3 (0.55) | NAMPTAKR1C3AKR1C2PDE4APDE4B | |
| SCHEMBL8650924 | 0.82 | AKR1C3 (0.55) | NAMPTAKR1C3AKR1C2PDE4APDE4B | |
| SCHEMBL8648534 | 0.82 | CYP1A1 (0.55) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 |
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-0861831-A1 | HETEROARYL-SUBSTITUTED ACRYLOYLGUANIDINE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-09-02 | — | — | EP | disclosed |