Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | MEN1 | O00255 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9465336 | 0.85 | POLB (0.62) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL9465321 | 0.85 | POLB (0.62) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL19976958 | 0.84 | SMN1; SMN2 (0.56) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL29434873 | 0.83 | KDR (1.00) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL6260903 | 0.83 | KDR (1.00) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL19976894 | 0.82 | ALDH1A1 (0.62) | KMT2AMAPTMEN1ALDH1A1KDM4E | |
| SCHEMBL16993965 | 0.81 | HDAC1 (0.66) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL16999624 | 0.81 | HDAC1 (0.66) | KDRKMT2AMAPTMEN1NPC1 | |
| SCHEMBL19976989 | 0.81 | SMN1; SMN2 (0.53) | KDRKMT2AMAPTNPC1RAB9A | |
| SCHEMBL29152858 | 0.80 | SLC40A1 (0.70) | KDRKMT2AMAPTMEN1NPC1 |
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 |