Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976980 | 0.90 | NPC1 (0.66) | NPC1RAB9AALDH1A1LMNATDP1 | |
| SCHEMBL19977134 | 0.89 | HDAC1 (0.46) | NPC1RAB9AGPR139LMNAKMT2A | |
| SCHEMBL19976955 | 0.84 | POLB (0.53) | NPC1RAB9AALDH1A1LMNAMAPT | |
| SCHEMBL19976954 | 0.83 | KMT2A (0.53) | NPC1RAB9AALDH1A1LMNATDP1 | |
| SCHEMBL16999305 | 0.82 | USP30 (0.55) | GPR139HDAC1 | |
| SCHEMBL19977072 | 0.82 | LMNA (0.54) | GPR139LMNAKMT2AHPGDHTT | |
| SCHEMBL19977018 | 0.82 | SMN1; SMN2 (0.50) | NPC1RAB9AALDH1A1LMNAKMT2A | |
| SCHEMBL19976952 | 0.81 | APLNR (0.57) | NPC1RAB9AALDH1A1LMNAMAPT | |
| SCHEMBL19977070 | 0.81 | KCNK3 (0.48) | RAB9AALDH1A1LMNAMAPTHPGD | |
| SCHEMBL19976971 | 0.81 | HDAC1 (0.53) | NPC1RAB9ALMNAKMT2ARXFP1 |
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 |