Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.41 |
| ▸ | PRKAG1 | P54619 | 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 | |
|---|---|---|---|---|
| SCHEMBL21806659 | 0.95 | MKNK1 (0.46) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL16401323 | 0.85 | KMT2A (0.46) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL4045246 | 0.85 | KMT2A (0.46) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL26693436 | 0.83 | PARP1 (0.51) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| SCHEMBL3529098 | 0.83 | ALDH1A1 (0.47) | MEN1KMT2ACYP2D6CYP2C19POLB | |
| SCHEMBL17782257 | 0.83 | ALDH1A1 (0.47) | MEN1KMT2ACYP2D6CYP2C19POLB | |
| SCHEMBL4767634 | 0.82 | PARP1 (0.50) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 | |
| Hydrochloric Acid SCHEMBL17782206 | 0.81 | ALDH1A1 (0.46) | MEN1KMT2ACYP2D6CYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1652940 | 0.81 | ALDH1A1 (0.46) | MEN1KMT2ACYP2D6CYP2C19SMN1; SMN2 | |
| Acetic Acid SCHEMBL28115056 | 0.81 | MEN1 (0.54) | MEN1KMT2ACYP2D6CYP2C19CHRNB2 |
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-2009103478-A1 | PYRIDONE AND PYRIDAZINONE DERIVATIVES AS MCH ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-08-27 | — | — | WO | disclosed |