Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.52 |
| ▸ | DHPS | P49366 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976963 | 0.85 | TRPV1 (0.56) | TRPV1DHPSNPC1HTTRAB9A | |
| SCHEMBL19977044 | 0.84 | TRPV1 (0.53) | TRPV1DHPSNPC1HTTRAB9A | |
| SCHEMBL19976992 | 0.83 | TRPV1 (0.48) | TRPV1HTTLMNA | |
| SCHEMBL19977084 | 0.83 | DHPS (0.46) | DHPSNPC1HTTLMNAHPGD | |
| SCHEMBL16993988 | 0.82 | HPGDS (0.46) | TRPV1NPC1HTTRAB9ALMNA | |
| SCHEMBL16999367 | 0.82 | HPGDS (0.46) | TRPV1NPC1HTTRAB9ALMNA | |
| SCHEMBL19977099 | 0.81 | NPC1 (0.63) | TRPV1DHPSNPC1HTTRAB9A | |
| SCHEMBL19976905 | 0.80 | KMT2A (0.56) | DHPSNPC1ALDH1A1 | |
| SCHEMBL19977090 | 0.80 | DHPS (0.46) | TRPV1DHPSHTTLMNASMN1; SMN2 | |
| SCHEMBL19976913 | 0.78 | LMNA (0.43) | DHPSNPC1HTTLMNAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-9919998-B2 | Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2018-03-20 | — | — | US | disclosed |