Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.43 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15545516 | 0.86 | HTT (0.55) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL28334704 | 0.83 | KDM4E (0.68) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL7778418 | 0.83 | KDM4E (0.64) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL6891227 | 0.80 | ALDH1A1 (0.62) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL17457691 | 0.78 | ALDH1A1 (0.61) | POLBEPHX2MEN1KMT2AALDH1A1 | |
| SCHEMBL28504782 | 0.77 | KDM4E (0.57) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL24201340 | 0.77 | EPHX2 (0.62) | POLBEPHX2MEN1KMT2AALDH1A1 | |
| SCHEMBL24201247 | 0.77 | EPHX2 (0.62) | POLBEPHX2MEN1KMT2AALDH1A1 | |
| SCHEMBL10274700 | 0.77 | EPHX2 (0.54) | KDM4EHTTPOLBEPHX2MEN1 | |
| SCHEMBL13873443 | 0.74 | HTT (0.66) | KDM4EHTTPOLBEPHX2MEN1 |
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-0477912-B1 | Novel N-acyldipeptides, and pharmaceutical compositions containing the same | UNIV LJUBLJANI (SI) | 2001-08-29 | — | — | EP | disclosed |
| US-5514654-A | ANTITUMOR AGENTS AND IMMUNOMODULATORS | UNIV LJUBLJANI (SI) | 1996-05-07 | — | — | US | disclosed |
| EP-0477912-A2 | Novel N-acyldipeptides, processes for the preparation thereof and pharmaceutical compositions containing the same | UNIVERZA EDVARDA KARDELJA V LJUBLJANI, VDO FAKULTETA ZA NARAVOSLOVJE IN TEHNOLOGIJO, N.SOL.O., LUBLJANA (YU) | 1992-04-01 | — | — | EP | disclosed |