Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28174124 | 0.86 | KDM4E (0.53) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL668838 | 0.85 | KDM4E (0.69) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL1424790 | 0.83 | ALOX15 (0.48) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL1423804 | 0.82 | KDM4E (0.49) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL88994 | 0.82 | PLA2G2A (0.40) | KDM4EALDH1A1MEN1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL1425679 | 0.81 | ALOX15 (0.46) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL2671214 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1LMNATDP1CA12 | |
| Hydrochloric Acid SCHEMBL1424857 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL19330396 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1LMNATDP1CA12 | |
| SCHEMBL8235390 | 0.80 | PLA2G2A (0.55) | ALDH1A1 |
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-3233831-B1 | NOVEL FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES INC (US) | 2019-02-20 | — | — | EP | disclosed |