Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7512685 | 0.94 | BTK (0.38) | ALDH1A1KDM4EBTKHTTUSP2 | |
| SCHEMBL7824786 | 0.86 | DRD2 (0.37) | ALDH1A1KDM4EALOX15TP53HTT | |
| SCHEMBL7827942 | 0.84 | DRD2 (0.45) | ALDH1A1KDM4ESMN1; SMN2ALOX15TP53 | |
| SCHEMBL7818532 | 0.84 | L3MBTL3 (0.38) | KDM4ESMN1; SMN2BTKHTTPOLB | |
| SCHEMBL7827664 | 0.83 | ROCK2 (0.38) | KDM4E | |
| SCHEMBL7829164 | 0.78 | HRH3 (0.35) | ALDH1A1KDM4EBTKUSP2RXFP1 | |
| SCHEMBL7512428 | 0.76 | L3MBTL3 (0.31) | — | |
| SCHEMBL7510864 | 0.75 | — | — | |
| SCHEMBL7480136 | 0.75 | MAPT (0.33) | ALDH1A1KDM4ESMN1; SMN2TP53HPGD | |
| SCHEMBL7515406 | 0.75 | LMNA (0.48) | ALDH1A1KDM4ESMN1; SMN2TP53POLB |
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-0861250-B1 | AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2002-02-13 | — | — | EP | claimed |