Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | FPR1 | P21462 | 1/20 | 0.39 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 5/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.38 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | GAPDH | P04406 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27415402 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LMNANPSR1CYP2C9CYP2C19 | |
| SCHEMBL9745628 | 0.85 | ALDH1A1 (0.59) | ALDH1A1LMNANPSR1SMN1; SMN2 | |
| SCHEMBL9745446 | 0.85 | ALDH1A1 (0.59) | ALDH1A1LMNANPSR1SMN1; SMN2 | |
| SCHEMBL9745453 | 0.85 | ALDH1A1 (0.59) | ALDH1A1LMNANPSR1SMN1; SMN2 | |
| SCHEMBL27492314 | 0.84 | ALDH1A1 (0.52) | ALDH1A1LMNANPSR1KDM1AKCNH2 | |
| SCHEMBL16055833 | 0.84 | ALDH1A1 (0.46) | ALDH1A1LMNANPSR1FPR1GPBAR1 | |
| SCHEMBL27492313 | 0.84 | ALDH1A1 (0.52) | ALDH1A1LMNANPSR1KDM1AKCNH2 | |
| SCHEMBL27565973 | 0.79 | ALDH1A1 (0.45) | ALDH1A1LMNANPSR1SMN1; SMN2MEN1 | |
| SCHEMBL27565971 | 0.79 | ALDH1A1 (0.45) | ALDH1A1LMNANPSR1SMN1; SMN2MEN1 | |
| SCHEMBL18586607 | 0.76 | LMNA (0.50) | ALDH1A1LMNACYP2C9CYP2C19FPR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1210256-C | Diacylhydrazine derivs. | MERCK PATENT GMBH (DE) | 2005-07-13 | — | — | CN | disclosed |
| CN-1117077-C | 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors | PFIZER (US) | 2003-08-06 | — | — | CN | disclosed |
| CN-1360568-A | Diacylhydrazine derivs. | MERCK PATENT GMBH (DE) | 2002-07-24 | — | — | CN | disclosed |
| CN-1239952-A | 6-phenylpyridyl-2-amine derivatives useful as NOS inhibitors | PFIZER (US) | 1999-12-29 | — | — | CN | disclosed |