Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.66 |
| ▸ | RAB9A | P51151 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.52 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.52 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.52 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976970 | 0.90 | NPC1 (0.53) | NPC1RAB9AALDH1A1HPGDHTT | |
| SCHEMBL19976971 | 0.88 | HDAC1 (0.53) | NPC1RAB9AHTTKMT2AMEN1 | |
| SCHEMBL19976942 | 0.87 | MEN1 (0.52) | NPC1RAB9AALDH1A1HTTKMT2A | |
| SCHEMBL19976893 | 0.85 | SMN1; SMN2 (0.60) | NPC1RAB9AHPGDHTTKMT2A | |
| SCHEMBL19976899 | 0.84 | KMT2A (0.49) | NPC1RAB9AALDH1A1KMT2AMEN1 | |
| SCHEMBL19976972 | 0.83 | GAA (0.59) | NPC1RAB9AALDH1A1HTTKMT2A | |
| SCHEMBL19977032 | 0.83 | MAPT (0.55) | RAB9AALDH1A1HPGDHTTKMT2A | |
| SCHEMBL527994 | 0.82 | RAB9A (0.77) | NPC1RAB9AALDH1A1HPGDHTT | |
| SCHEMBL29989592 | 0.82 | RAB9A (0.77) | NPC1RAB9AALDH1A1HPGDHTT | |
| SCHEMBL19977030 | 0.82 | MAPT (0.57) | RAB9AALDH1A1HTTKMT2AMEN1 |
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 |