Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 3/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2420295 | 0.94 | MAPK11 (0.45) | BRAFMAPK14MAPK11CHRNA7KDM4E | |
| SCHEMBL2417237 | 0.94 | MAPK11 (0.43) | BRAFMAPK14MAPK11LMNACHRNA7 | |
| SCHEMBL2423094 | 0.89 | MAPK11 (0.50) | MAPK14MAPK11CHRNA7KDM5AKDM4E | |
| Trifluoroacetic Acid SCHEMBL2418838 | 0.83 | CHRNA7 (0.38) | CHRNA7MAPTRAB9ABRD4 | |
| Trifluoroacetic Acid SCHEMBL222702 | 0.81 | HRH3 (0.35) | MAPK14ALDH1A1MAPTRAB9ABRD4 | |
| Trifluoroacetic Acid SCHEMBL2417740 | 0.80 | NTRK1 (0.38) | CHRNA7 | |
| Trifluoroacetic Acid SCHEMBL444415 | 0.79 | KCNH2 (0.41) | ALDH1A1MAPTRAB9A | |
| Trifluoroacetic Acid SCHEMBL220163 | 0.78 | GPR6 (0.35) | — | |
| Trifluoroacetic Acid SCHEMBL223098 | 0.78 | KMT2A (0.41) | ALDH1A1MAPTRAB9A | |
| Trifluoroacetic Acid SCHEMBL223636 | 0.78 | PKM (0.45) | KDM4EALDH1A1MAPTHPGDHSD17B10 |
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-2212282-B1 | SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF | SANOFI SA (FR) | 2011-09-21 | — | — | EP | disclosed |