Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11077024 | 0.91 | LMNA (0.42) | NAAASPHK1LMNAABCB11MAPK1 | |
| SCHEMBL11080350 | 0.86 | ABCB11 (0.44) | SPHK1LMNAABCB11MAPK1MAPT | |
| SCHEMBL11073831 | 0.85 | CYP1A2 (0.43) | NAAALMNAABCB11MAPK1MAPT | |
| SCHEMBL11081534 | 0.85 | CYP1A2 (0.43) | NAAALMNAABCB11MAPK1MAPT | |
| SCHEMBL11075284 | 0.84 | ABCB11 (0.39) | NAAALMNAABCB11MAPK1MAPT | |
| SCHEMBL11219714 | 0.82 | SLC1A3 (0.40) | NAAASPHK1LMNASPHK2 | |
| SCHEMBL11078904 | 0.82 | SLC1A3 (0.34) | NAAASPHK1SPHK2 | |
| SCHEMBL11068114 | 0.81 | ABCB11 (0.41) | NAAALMNAABCB11MAPK1MAPT | |
| SCHEMBL11070504 | 0.81 | SMN1; SMN2 (0.41) | NAAAABCB11CYP1A2 | |
| SCHEMBL11069034 | 0.81 | ABCB11 (0.54) | SPHK1LMNAABCB11MAPK1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4430339-A | PROPHYLAXIS, METABOLISM, GLUCOSE, FATS, HYPOGLYCEMIC AGENTS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-02-07 | — | — | US | disclosed |
| WO-1982000822-A1 | SUBSTITUTED OXIRANECARBOXYLIC ACIDS,THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | EISTETTER K | 1982-03-18 | — | — | WO | disclosed |