Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7328944 | 0.94 | KDM4E (0.50) | ALDH1A1KDM4EL3MBTL1SMN1; SMN2MAPK1 | |
| SCHEMBL16370933 | 0.80 | L3MBTL1 (0.71) | ALDH1A1KDM4EL3MBTL1SMN1; SMN2MAPK1 | |
| SCHEMBL7327720 | 0.77 | KDM4E (0.53) | ALDH1A1KDM4ESMN1; SMN2KMT2ASIGMAR1 | |
| SCHEMBL22639911 | 0.72 | L3MBTL1 (0.67) | NPC1L3MBTL1SMN1; SMN2MAPK1GAA | |
| SCHEMBL22639809 | 0.72 | L3MBTL1 (0.67) | NPC1L3MBTL1SMN1; SMN2MAPK1GAA | |
| SCHEMBL7328952 | 0.71 | KDM4E (0.52) | ALDH1A1KDM4ENPC1L3MBTL1SMN1; SMN2 | |
| SCHEMBL18782322 | 0.68 | USP2 (0.47) | ALDH1A1KDM4ENPC1L3MBTL1MAPK1 | |
| SCHEMBL20405327 | 0.67 | KDM4E (0.60) | ALDH1A1KDM4ENPC1SIGMAR1TSHR | |
| SCHEMBL16423966 | 0.67 | KDM4E (0.60) | ALDH1A1KDM4ENPC1SIGMAR1TSHR | |
| SCHEMBL20405355 | 0.67 | KDM4E (0.60) | ALDH1A1KDM4ENPC1SIGMAR1TSHR |
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-0629190-A1 | COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-12-21 | — | — | EP | claimed |
| WO-1993015052-A1 | COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-08-05 | — | — | WO | claimed |