Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.54 |
| ▸ | GRIA2 | P42262 | 5/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | TDP2 | O95551 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | FPR2 | P25090 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4288434 | 1.00 | KDM1A (0.54) | KDM1AGRIA2KCNH2KIF11ALDH1A1 | |
| SCHEMBL4288425 | 1.00 | KDM1A (0.54) | KDM1AGRIA2KCNH2KIF11ALDH1A1 | |
| SCHEMBL4288431 | 1.00 | KDM1A (0.54) | KDM1AGRIA2KCNH2KIF11ALDH1A1 | |
| SCHEMBL4291010 | 0.85 | HRH3 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL4291017 | 0.85 | HRH3 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL4291020 | 0.85 | HRH3 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL13663365 | 0.85 | HRH3 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL4292888 | 0.81 | NPC1 (0.45) | ALDH1A1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL4292890 | 0.81 | NPC1 (0.45) | ALDH1A1RAB9ALMNAMEN1KMT2A | |
| SCHEMBL7026821 | 0.81 | NPC1 (0.45) | ALDH1A1RAB9ALMNAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1326863-A2 | OCTAHYDRO-INDOLIZINES AND QUINOLIZINES AND HEXAHYDRO-PYRROLIZINES | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-07-16 | — | — | EP | claimed |
| WO-2002024695-A2 | OCTAHYDRO-INDOLIZINES AND QUINOLIZINES AND HEXAHYDRO-PYRROLIZINES | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-03-28 | — | — | WO | claimed |