Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13317137 | 1.00 | SMN1; SMN2 (0.53) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL18193546 | 0.83 | ATM (0.68) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL5449384 | 0.81 | ATM (0.54) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL5449388 | 0.81 | ATM (0.54) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL14604957 | 0.81 | ATM (0.54) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL13317225 | 0.80 | ATM (0.48) | SMN1; SMN2KMT2AATMCES2CES1 | |
| SCHEMBL9768797 | 0.80 | KDM4E (0.38) | SMN1; SMN2KMT2AALDH1A1MAPTNPSR1 | |
| SCHEMBL4702050 | 0.80 | C1S (0.46) | SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1 | |
| SCHEMBL4702047 | 0.80 | C1S (0.46) | SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1 | |
| SCHEMBL816510 | 0.78 | CES2 (0.54) | SMN1; SMN2KMT2AATMCES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0683770-A1 | SUBSTITUTED TETRAHYDROPYRIDAZINE CARBOXAMIDES | BAYER AG (DE) | 1995-11-29 | — | — | EP | claimed |
| WO-1994018174-A1 | SUBSTITUTED TETRAHYDROPYRIDAZINE CARBOXAMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1994-08-18 | — | — | WO | claimed |
| EP-0683770-A1 | SUBSTITUTED TETRAHYDROPYRIDAZINE CARBOXAMIDES | BAYER AG (DE) | 1995-11-29 | — | — | EP | disclosed |
| WO-1994018174-A1 | SUBSTITUTED TETRAHYDROPYRIDAZINE CARBOXAMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1994-08-18 | — | — | WO | disclosed |