Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 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 | |
|---|---|---|---|---|
| SCHEMBL19976937 | 0.88 | TP53 (0.52) | MRGPRX1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL19977052 | 0.88 | MRGPRX1 (0.47) | MRGPRX1SMN1; SMN2LMNAMEN1KMT2A | |
| SCHEMBL19976991 | 0.88 | MRGPRX1 (0.47) | MRGPRX1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL19976896 | 0.85 | SMN1; SMN2 (0.47) | MRGPRX1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL16993885 | 0.83 | CTSL (0.48) | MRGPRX1NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL19977126 | 0.81 | MRGPRX1 (0.44) | MRGPRX1NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL19976994 | 0.80 | PGR (0.57) | NPC1RAB9APOLBLMNAMEN1 | |
| SCHEMBL19976988 | 0.79 | MEN1 (0.52) | MRGPRX1NPC1RAB9ASMN1; SMN2POLB | |
| SCHEMBL19977128 | 0.79 | F2R (0.45) | MRGPRX1NPC1SMN1; SMN2POLBLMNA | |
| SCHEMBL19977043 | 0.79 | MAPT (0.53) | NPC1RAB9ASMN1; SMN2POLBLMNA |
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 |