Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SERPINH1 | P50454 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8366432 | 0.91 | HTR3A (0.43) | HTR3APARP1KDM4EALDH1A1SERPINH1 | |
| SCHEMBL219830 | 0.83 | HTR3A (0.50) | HTR3APARP1KDM4EALDH1A1 | |
| SCHEMBL31306041 | 0.82 | MAPT (0.49) | HTR3APARP1KDM4EALDH1A1CYP2A6 | |
| SCHEMBL12284064 | 0.82 | PARP1 (0.48) | HTR3APARP1KDM4EALDH1A1CYP2A6 | |
| SCHEMBL4644440 | 0.82 | MAPT (0.49) | HTR3APARP1KDM4EALDH1A1CYP2A6 | |
| SCHEMBL4387990 | 0.81 | HTR3A (0.51) | HTR3APARP1 | |
| SCHEMBL30094449 | 0.81 | HTR3A (0.51) | HTR3APARP1 | |
| SCHEMBL2554903 | 0.81 | PARP1 (0.43) | HTR3APARP1KDM4EALDH1A1CYP2A6 | |
| SCHEMBL30546095 | 0.79 | PARP1 (0.42) | HTR3APARP1KDM4EALDH1A1CYP2A6 | |
| SCHEMBL4011401 | 0.79 | PARP1 (0.46) | HTR3APARP1KDM4EALDH1A1CYP2A6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0977600-A2 | CONTRAST AGENTS | NYCOMED IMAGING A/S (NO) | 2000-02-09 | — | — | EP | disclosed |
| US-5929089-A | ANTISEROTONINE AGENT | SYNTHELABO (FR) | 1999-07-27 | — | — | US | disclosed |
| WO-1998047541-A1 | CONTRAST AGENTS | NYCOMED IMAGING AS (NO) | 1998-10-29 | — | — | WO | disclosed |