Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 2/20 | 0.41 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 5/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14570075 | 0.83 | NAAA (0.39) | NAAAALOX5APFEN1CARM1 | |
| SCHEMBL12648042 | 0.81 | NAAA (0.43) | NAAATRPV3S1PR1S1PR3S1PR5 | |
| SCHEMBL10304785 | 0.81 | AKR1C3 (0.42) | CYP11B1CYP11B2CARM1 | |
| SCHEMBL12591809 | 0.80 | NAAA (0.43) | NAAATRPV3S1PR1S1PR3CYP11B1 | |
| SCHEMBL13385400 | 0.80 | ALDH1A1 (0.35) | NAAAALOX5APFEN1CARM1 | |
| SCHEMBL23964820 | 0.78 | ALDH1A1 (0.44) | CARM1 | |
| SCHEMBL19644906 | 0.78 | CYP11B1 (0.43) | NAAATRPV3CYP11B1CYP11B2ALOX5AP | |
| SCHEMBL15576310 | 0.78 | LMNA (0.39) | CARM1KCNQ3KCNQ2 | |
| SCHEMBL10304809 | 0.75 | TNKS2 (0.41) | — | |
| SCHEMBL16342291 | 0.74 | RXRA (0.32) | RXRARXRBRXRG |
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-2018060949-A1 | TRYPTOPHAN HYDROXYLASE INHIBITORS FOR USE IN THE TREATMENT OF LIVER DISEASES | ROIVANT SCIENCES GMBH (CH) | 2018-04-05 | — | — | WO | disclosed |