Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HSPA5 | P11021 | 3/20 | 0.43 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.41 |
| ▸ | HSPA2 | P54652 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL19976914 | 0.82 | PARP1 (0.54) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL16994020 | 0.82 | HSPA5 (0.57) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL19976902 | 0.81 | SMN1; SMN2 (0.45) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL18272412 | 0.81 | USP30 (0.48) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL24862930 | 0.80 | HPGD (0.51) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL19977034 | 0.79 | PARP1 (0.46) | MEN1KMT2APARP1RAB9ANPC1 | |
| SCHEMBL19976949 | 0.78 | KMT2A (0.45) | MEN1KMT2ATRPV1POLBNR3C1 | |
| SCHEMBL19977033 | 0.78 | TRPV1 (0.45) | KMT2ATRPV1HPGDNR3C1PGR | |
| SCHEMBL19976901 | 0.77 | GAA (0.59) | MEN1KMT2ARAB9ANPC1MAPT | |
| SCHEMBL19976962 | 0.76 | TRPV1 (0.52) | MEN1KMT2ATRPV1MAPK1 |
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 |