Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 4/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL246959 | 0.94 | TAAR1 (0.48) | SRD5A2TAAR1IDO1KIF11MIF | |
| SCHEMBL2267261 | 0.88 | KIF11 (0.57) | TAAR1IDO1KIF11MIFDAO | |
| SCHEMBL2096666 | 0.82 | SRD5A2 (0.59) | SRD5A2TAAR1IDO1KIF11LTA4H | |
| SCHEMBL8763328 | 0.82 | KMT2A (0.42) | KDM4EALDH1A1KMT2A | |
| SCHEMBL31739219 | 0.80 | KIF11 (0.68) | SRD5A2TAAR1IDO1KIF11LTA4H | |
| SCHEMBL3246600 | 0.77 | TAAR1 (0.54) | SRD5A2TAAR1IDO1KIF11MIF | |
| SCHEMBL9953772 | 0.77 | IDO1 (0.41) | TAAR1IDO1MIFDAOMAOB | |
| SCHEMBL21029938 | 0.77 | ALDH1A1 (0.37) | TAAR1IDO1KIF11MIFDAO | |
| SCHEMBL7594667 | 0.76 | RXRA (0.54) | KIF11MAOBNAAA | |
| SCHEMBL146076 | 0.75 | SRD5A2 (0.49) | SRD5A2TAAR1IDO1KIF11LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| US-4874763-A | ANTIARRHYTHMIA AGENTS | ROEHM GMBH CHEMISCHE FABRIK (DE) | 1989-10-17 | — | — | US | disclosed |
| EP-0318795-A2 | Pharmaceutically active pteridin derivatives | Röhm GmbH (DE) | 1989-06-07 | — | — | EP | disclosed |