Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL9059356 | 0.83 | AKR1C3 (0.46) | SMN1; SMN2L3MBTL1KDM4EAKR1C3ALDH1A1 | |
| SCHEMBL9059338 | 0.75 | ALDH1A1 (0.42) | SMN1; SMN2GAAL3MBTL1AKR1C3ALDH1A1 | |
| SCHEMBL9059454 | 0.73 | ALDH1A1 (0.49) | SMN1; SMN2GAAKDM4EALDH1A1MEN1 | |
| SCHEMBL9059530 | 0.71 | MAPT (0.50) | SMN1; SMN2GAAL3MBTL1ALDH1A1TSHR | |
| SCHEMBL9059917 | 0.71 | SMN1; SMN2 (0.41) | SMN1; SMN2GAAL3MBTL1HTTKDM4E | |
| SCHEMBL9059919 | 0.71 | SMN1; SMN2 (0.41) | SMN1; SMN2GAAL3MBTL1HTTKDM4E | |
| SCHEMBL9060925 | 0.70 | ALDH1A1 (0.38) | SMN1; SMN2L3MBTL1HTTKDM4EAKR1C3 | |
| SCHEMBL12989307 | 0.69 | MAPT (0.64) | SMN1; SMN2GAAHTTALDH1A1MEN1 | |
| SCHEMBL7507203 | 0.69 | HTT (0.55) | SMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL9059323 | 0.68 | SMN1; SMN2 (0.44) | SMN1; SMN2GAAL3MBTL1HTTALDH1A1 |
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-1996017612-A1 | USE OF SUBSTITUTED PHENYLAMIDINE AND PHENYLGUANIDINE COMPOUNDS FOR THE TREATMENT OF CEREBRAL AND CARDIAC ISCHAEMIA, CONVULSION AND SICKLE CELL ANAEMIA | KNOLL AKTIENGESELLSCHAFT (DE) | 1996-06-13 | — | — | WO | disclosed |