Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | PKLR | P30613 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 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 | |
|---|---|---|---|---|
| SCHEMBL12818485 | 0.89 | PDE3B (0.39) | PKMPKLRCYP2C9MEN1KMT2A | |
| SCHEMBL12818506 | 0.88 | CYP2C9 (0.42) | PKMPKLRCYP2C9MEN1KMT2A | |
| SCHEMBL12818990 | 0.86 | CYP2C9 (0.38) | CYP2C9MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL12818912 | 0.85 | PIK3CA (0.42) | CYP2C9MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL12818327 | 0.83 | CYP11B1 (0.38) | PKMPKLRCYP11B1CYP11B2MAPT | |
| SCHEMBL12818721 | 0.83 | CYP2C9 (0.40) | PKMPKLRCYP2C9MEN1KMT2A | |
| SCHEMBL1818601 | 0.83 | CYP2C9 (0.57) | PKMPKLRCYP2C9CYP11B1CYP11B2 | |
| SCHEMBL12818812 | 0.82 | CYP2C9 (0.43) | PKMCYP2C9MEN1KMT2AALDH1A1 | |
| SCHEMBL12818595 | 0.82 | CYP11B1 (0.37) | PKMPKLRCYP2C9CYP11B1CYP11B2 | |
| SCHEMBL12818598 | 0.82 | CYP11B1 (0.37) | PKMPKLRCYP2C9CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012130306-A1 | BICYCLIC 2,3-DIHYRDOBENZAZINE COMPOUNDS FOR USE IN THERAPY | ELARA PHARMACEUTICALS GMBH (DE) | 2012-10-04 | — | — | WO | claimed |
| WO-2012130306-A1 | BICYCLIC 2,3-DIHYRDOBENZAZINE COMPOUNDS FOR USE IN THERAPY | ELARA PHARMACEUTICALS GMBH (DE) | 2012-10-04 | — | — | WO | disclosed |