Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 8/20 | 0.55 |
| ▸ | WNT3A | P56704 | 8/20 | 0.55 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.48 |
| ▸ | FABP3 | P05413 | 1/20 | 0.46 |
| ▸ | FABP4 | P15090 | 1/20 | 0.46 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29987426 | 0.84 | CTNNB1 (0.63) | CTNNB1WNT3AMRGPRX4HTR1BTAS1R3 | |
| SCHEMBL28136918 | 0.84 | CTNNB1 (0.45) | CTNNB1WNT3AMRGPRX4PTPN1HTR1B | |
| SCHEMBL663873 | 0.84 | CTNNB1 (0.63) | CTNNB1WNT3AMRGPRX4HTR1BTAS1R3 | |
| Benzofuran SCHEMBL28047319 | 0.82 | KMT2A (0.45) | CTNNB1WNT3AFABP3FABP4FABP5 | |
| SCHEMBL28136913 | 0.76 | HTR1B (0.41) | CTNNB1WNT3AMRGPRX4PTPN1HTR1B | |
| SCHEMBL1919332 | 0.76 | MRGPRX4 (0.58) | CTNNB1WNT3AMRGPRX4FABP3FABP4 | |
| Terephthalic Acid SCHEMBL27476722 | 0.76 | ALDH1A1 (0.56) | PTPN1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11458005 | 0.75 | CTNNB1 (0.71) | CTNNB1WNT3AHTR1BIDO1NAMPT | |
| SCHEMBL10532325 | 0.75 | ALDH1A1 (0.53) | PTPN1NPC1RAB9A | |
| SCHEMBL28782405 | 0.74 | KMT2A (0.43) | NPC1RAB9ASMN1; SMN2 |
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-107709315-A | The inhibitor of bruton's tyrosine kinase | 药品循环有限责任公司 | 2018-02-16 | — | — | CN | disclosed |