Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18285758 | 1.00 | ALDH1A1 (0.33) | ALDH1A1SMN1; SMN2MAPTS1PR1PKM | |
| SCHEMBL21683027 | 0.78 | HSD11B1 (0.41) | ALDH1A1SMN1; SMN2LMNACYP1A2CYP2C9 | |
| SCHEMBL1078194 | 0.75 | RAF1 (0.40) | ALDH1A1SMN1; SMN2MAPTHTTPOLB | |
| SCHEMBL21683014 | 0.74 | HSD11B1 (0.39) | ALDH1A1SMN1; SMN2LMNACYP1A2CYP2C9 | |
| SCHEMBL3393922 | 0.73 | MEN1 (0.47) | ALDH1A1SMN1; SMN2LMNAGAAKMT2A | |
| SCHEMBL1078190 | 0.71 | EPHX2 (0.34) | ALDH1A1SMN1; SMN2MAPTHTTPOLB | |
| SCHEMBL29884115 | 0.69 | GRIN1 (0.48) | ALDH1A1HTTL3MBTL1KDM4EKMT2A | |
| SCHEMBL3391147 | 0.69 | HSD11B1 (0.44) | ALDH1A1SMN1; SMN2PKMLMNAKMT2A | |
| SCHEMBL6071816 | 0.68 | NQO1 (0.37) | ALDH1A1MAPTLMNAKDM4EBLM | |
| SCHEMBL21683080 | 0.67 | HIF1A (0.35) | ALDH1A1CYP1A2CYP2C9CYP2C19KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3303334-A1 | TYROSINE KINASE INHIBITORS | Principia Biopharma Inc. (US) | 2018-04-11 | — | — | EP | disclosed |
| WO-2016196840-A1 | TYROSINE KINASE INHIBITORS | PRINCIPIA BIOPHARMA INC. (US) | 2016-12-08 | — | — | WO | disclosed |