Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 13/20 | 0.44 |
| ▸ | HTR2A | P28223 | 12/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL17767981 | 1.00 | HTR2C (0.44) | HTR2CHTR2ACHRM4ARRET | |
| SCHEMBL17768133 | 0.90 | HTR2A (0.42) | HTR2CHTR2ANPC1RAB9AKDM4E | |
| SCHEMBL17767930 | 0.90 | HTR2A (0.39) | HTR2CHTR2ACHRM4NPC1RAB9A | |
| SCHEMBL17778720 | 0.89 | HTR2C (0.45) | HTR2CHTR2AHTR2BKMT2A | |
| SCHEMBL17767932 | 0.89 | HTR2A (0.45) | HTR2CHTR2A | |
| SCHEMBL17778820 | 0.87 | HTR2C (0.46) | HTR2CHTR2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL19706727 | 0.85 | HTR2A (0.36) | HTR2CHTR2ACHRM4NPC1RAB9A | |
| SCHEMBL17778467 | 0.83 | MTOR (0.46) | HTR2CHTR2A | |
| SCHEMBL17768124 | 0.82 | HTR2A (0.41) | HTR2CHTR2ACYP1A2 | |
| SCHEMBL16754458 | 0.82 | HTR2C (0.40) | HTR2CHTR2ACHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016079709-A1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-26 | — | — | WO | disclosed |