Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 5/20 | 0.41 |
| ▸ | NOS1 | P29475 | 5/20 | 0.41 |
| ▸ | NOS2 | P35228 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6999033 | 0.99 | NOS3 (0.42) | NOS3NOS1NOS2HTTMAOA | |
| SCHEMBL6613613 | 0.96 | NOS3 (0.45) | NOS3NOS1NOS2HTTMAOA | |
| Hydrochloric Acid SCHEMBL6302923 | 0.95 | NOS3 (0.46) | NOS3NOS1NOS2HTTMAOA | |
| SCHEMBL6993351 | 0.89 | NOS3 (0.42) | NOS3NOS1NOS2HTTMEN1 | |
| Hydrochloric Acid SCHEMBL6996690 | 0.88 | NOS3 (0.44) | NOS3NOS1NOS2HTTMEN1 | |
| Hydrochloric Acid SCHEMBL6999135 | 0.87 | MEN1 (0.43) | NOS3NOS1NOS2HTTPOLB | |
| SCHEMBL7002475 | 0.85 | NOS3 (0.55) | NOS3NOS1NOS2CYP1A2CYP3A4 | |
| SCHEMBL6993022 | 0.85 | L3MBTL1 (0.41) | NOS3NOS1NOS2POLBCYP1A2 | |
| SCHEMBL6611984 | 0.85 | PARP1 (0.45) | NOS3NOS1NOS2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7004141 | 0.84 | NOS1 (0.57) | NOS3NOS1NOS2CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | claimed |