Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.35 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.35 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL7700170 | 0.89 | NOS3 (0.38) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL7703215 | 0.83 | KMT2A (0.44) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL7702368 | 0.78 | NOS3 (0.41) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL7698346 | 0.77 | TSHR (0.42) | ALDH1A1LMNA | |
| SCHEMBL27492217 | 0.73 | ALDH1A1 (0.56) | ALDH1A1KDM4EAKR1B1MAOANOS3 | |
| SCHEMBL8510510 | 0.68 | NOS3 (0.41) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL8507650 | 0.66 | NOS3 (0.45) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL7697968 | 0.65 | PRCP (0.47) | — | |
| SCHEMBL29384557 | 0.65 | MAPK10 (0.55) | ALDH1A1KDM4EMAOANOS3NOS2 | |
| SCHEMBL163051 | 0.65 | MAPK10 (0.55) | ALDH1A1KDM4EMAOANOS3NOS2 |
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-0901488-B1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | BASILEA PHARMACEUTICA AG (CH) | 2002-11-06 | — | — | EP | disclosed |