Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.33 |
| ▸ | ITGAL | P20701 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | SDCBP | O00560 | 1/20 | 0.31 |
| ▸ | SDC2 | P34741 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9104473 | 0.92 | LMNA (0.39) | GPBAR1ITGB2ICAM1ITGALMAPT | |
| SCHEMBL9105245 | 0.91 | ALDH1A1 (0.41) | MAPTALDH1A1KDM4ELMNATSHR | |
| SCHEMBL3701796 | 0.89 | MEN1 (0.35) | MAPTHDAC1HDAC8HDAC6NPC1 | |
| SCHEMBL3701709 | 0.89 | HPGD (0.40) | GPBAR1MAPTHDAC1HDAC8HDAC6 | |
| SCHEMBL9099926 | 0.89 | HDAC1 (0.32) | GPBAR1ITGB2ICAM1ITGALMAPT | |
| SCHEMBL9105229 | 0.89 | ITGB2 (0.39) | ITGB2ICAM1ITGALMAPTHDAC1 | |
| SCHEMBL9104212 | 0.88 | ALDH1A1 (0.40) | MAPTALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL3702422 | 0.88 | GPBAR1 (0.35) | GPBAR1ITGB2ICAM1ITGALHDAC1 | |
| SCHEMBL9107195 | 0.86 | MEN1 (0.41) | MAPTNPC1RAB9AALDH1A1TSHR | |
| SCHEMBL3702498 | 0.86 | HPGD (0.39) | MAPTHDAC8ALDH1A1KDM4EMEN1 |
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-2460798-A2 | APAF-1 INHIBITOR COMPOUNDS | Laboratorios SALVAT, S.A. (ES) | 2012-06-06 | — | — | EP | disclosed |