Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 2/20 | 0.45 |
| ▸ | LTA4H | P09960 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | BAX | Q07812 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28203624 | 1.00 | GAA (0.47) | GAARAF1LTA4HCYP1A2CYP2C9 | |
| SCHEMBL16792531 | 0.82 | GAA (0.47) | GAARAF1LTA4HCYP1A2CYP2C9 | |
| SCHEMBL20040887 | 0.81 | GAA (0.50) | GAARAF1LTA4HCYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL2868615 | 0.81 | GAA (0.46) | GAARAF1LTA4HCYP1A2CYP2C9 | |
| SCHEMBL21295538 | 0.79 | RAF1 (0.58) | RAF1CYP1A2CYP2C9DHODHRAB9A | |
| SCHEMBL2866545 | 0.77 | GAA (0.58) | GAAALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL14384849 | 0.77 | RAF1 (0.56) | RAF1CYP1A2CYP2C9DHODHALDH1A1 | |
| SCHEMBL30358264 | 0.77 | LTA4H (0.55) | LTA4HTSHRTDP1L3MBTL1MAOB | |
| SCHEMBL4454151 | 0.77 | LTA4H (0.55) | LTA4HTSHRTDP1L3MBTL1MAOB | |
| SCHEMBL10007534 | 0.77 | LTA4H (0.55) | LTA4HTSHRTDP1L3MBTL1MAOB |
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-113105475-B | Inhibitors of bruton's tyrosine kinase and methods of use thereof | 詹森药业有限公司 | 2022-09-09 | — | — | CN | disclosed |