Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL22180343 | 1.00 | CYP2A13 (0.48) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL22180112 | 1.00 | CYP2A13 (0.48) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL22179872 | 1.00 | CYP2A13 (0.48) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL22180327 | 0.91 | CYP2A13 (0.42) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL25148889 | 0.77 | CYP2A13 (0.41) | CYP2A13SMN1; SMN2ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL3634645 | 0.77 | CYP2A13 (0.41) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL12422172 | 0.77 | CYP2A13 (0.46) | CYP2A13SMN1; SMN2ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL3278198 | 0.77 | CYP2A13 (0.41) | CYP2A13SMN1; SMN2ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL21827557 | 0.77 | CYP2A13 (0.41) | CYP2A13SMN1; SMN2ALDH1A1HPGDCA12 | |
| SCHEMBL12716769 | 0.77 | CYP2A13 (0.46) | CYP2A13SMN1; SMN2ALDH1A1HPGDL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018044808-A1 | INHIBITORS OF DUAL LEUCINE ZIPER (DLK) KINASE FOR THE TREATMENT OF DISEASE | BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) | 2018-03-08 | — | — | WO | disclosed |