Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3918671 | 0.79 | TAAR1 (0.39) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL15066876 | 0.75 | ALDH1A1 (0.41) | PARP10ALDH1A1POLBKMT2AGLA | |
| SCHEMBL28008213 | 0.74 | TDP1 (0.35) | GAACARM1 | |
| SCHEMBL28008146 | 0.74 | TDP1 (0.35) | GAACARM1 | |
| SCHEMBL27842461 | 0.74 | PARP10 (0.39) | PARP10CSNK2A1ALDH1A1POLBKMT2A | |
| SCHEMBL27999329 | 0.74 | MAPT (0.39) | CSNK2A1ALDH1A1POLBKMT2AGAA | |
| SCHEMBL28051634 | 0.74 | FYN (0.32) | — | |
| SCHEMBL7670255 | 0.73 | ALDH1A1 (0.43) | ALDH1A1POLBGAA | |
| SCHEMBL676545 | 0.73 | ALDH1A1 (0.40) | PARP10ALDH1A1POLBKMT2AGLA | |
| SCHEMBL2193008 | 0.73 | ALDH1A1 (0.40) | PARP10ALDH1A1POLBKMT2AGLA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108884106-A | POLYCYCLIC COMPOUNDS AS INHIBITORS OF BRUTON'S TYROSINE KINASE | 詹森药业有限公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-104144927-B | S1p receptor modulators | 明治制果药业株式会社 | 2016-08-24 | — | — | CN | disclosed |
| CN-104144927-A | Novel S1P receptor modulator | MEIJI SEIKA PHARMA CO LTD | 2014-11-12 | — | — | CN | disclosed |