Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.55 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 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 | |
|---|---|---|---|---|
| SCHEMBL14483736 | 0.84 | CYP11B1 (0.68) | CYP11B1CYP11B2TDP1MAOAMAOB | |
| SCHEMBL18290496 | 0.84 | CYP3A4 (0.47) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| SCHEMBL1882019 | 0.84 | CYP3A4 (0.47) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| SCHEMBL31138008 | 0.84 | CYP11B1 (0.68) | CYP11B1CYP11B2TDP1MAOAMAOB | |
| Hydrochloric Acid SCHEMBL17583800 | 0.82 | CYP3A4 (0.46) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| SCHEMBL14092962 | 0.80 | CYP3A4 (0.41) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| SCHEMBL10104435 | 0.80 | NR2E1 (0.42) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| Hydrochloric Acid SCHEMBL4425277 | 0.78 | CYP19A1 (0.48) | CYP11B1ALDH1A1KMT2ACYP19A1MEN1 | |
| SCHEMBL588961 | 0.77 | NR2E1 (0.56) | CYP11B1CYP11B2ALDH1A1TDP1KMT2A | |
| SCHEMBL30880594 | 0.77 | CYP11B1 (0.59) | CYP11B1CYP11B2TDP1MAOAMAOB |
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-1999009845-A1 | IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-03-04 | — | — | WO | claimed |