Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | CCKAR | P32238 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3936366 | 0.84 | KDR (0.54) | SMN1; SMN2LMNAKDRALDH1A1HTT | |
| SCHEMBL27699226 | 0.82 | KDR (0.52) | SMN1; SMN2LMNAKDRALDH1A1HTT | |
| SCHEMBL18261130 | 0.82 | USP30 (0.51) | CCKARKMT2AUSP30 | |
| SCHEMBL16999540 | 0.82 | USP30 (0.51) | CCKARKMT2AUSP30 | |
| SCHEMBL19977099 | 0.79 | NPC1 (0.63) | SMN1; SMN2LMNAALDH1A1HTTNPC1 | |
| SCHEMBL29791629 | 0.77 | MEN1 (0.41) | SMN1; SMN2ALDH1A1NPC1RAB9ANPSR1 | |
| SCHEMBL6933152 | 0.76 | GAA (0.50) | SMN1; SMN2KDRALDH1A1HTTNPC1 | |
| SCHEMBL19977141 | 0.76 | DHPS (0.56) | SMN1; SMN2NPC1RAB9APTPN22USP30 | |
| SCHEMBL24863091 | 0.76 | HTT (0.46) | SMN1; SMN2KDRGPR139ALDH1A1HTT | |
| SCHEMBL19977039 | 0.76 | KDR (0.70) | SMN1; SMN2KDRALDH1A1HTTNPC1 |
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 |