Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL25428617 | 0.81 | NR1H2 (0.55) | MAPTMAPK1ESR2 | |
| SCHEMBL27940431 | 0.78 | HPGD (0.47) | ALDH1A1SMN1; SMN2MAPK1GAAHPGD | |
| SCHEMBL2594044 | 0.78 | NOS3 (0.47) | MAPTKMT2AMEN1NPC1TP53 | |
| SCHEMBL22466192 | 0.78 | GAA (0.39) | KMT2AMEN1ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL5600099 | 0.77 | KMT2A (0.45) | MAPTTAS1R3TAS1R1TAS1R2KMT2A | |
| SCHEMBL28707742 | 0.77 | CYP11B2 (0.39) | ALDH1A1 | |
| SCHEMBL25209956 | 0.76 | GPR142 (0.59) | MAPTKMT2AMEN1ALDH1A1NPC1 | |
| SCHEMBL22583571 | 0.75 | CYP11B2 (0.38) | ALDH1A1KDM4EHPGD | |
| SCHEMBL29077472 | 0.74 | KMT2A (0.34) | KMT2AMEN1NPC1SMN1; SMN2MAPK1 | |
| SCHEMBL28369820 | 0.74 | AKR1C3 (0.52) | MAPTESR1ESR2SPR |
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 |
|---|---|---|---|---|---|---|---|
| CN-116783190-A | N- (phenylaminocarbonyl) tetrahydroisoquinolines and related compounds as modulators of GPR65 | 帕蒂奥斯治疗有限公司 | 2023-09-19 | — | — | CN | disclosed |