Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.63 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.63 |
| ▸ | RAB9A | P51151 | 5/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16121109 | 0.83 | ALDH1A1 (0.61) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL1314187 | 0.82 | ALDH1A1 (0.76) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL8427710 | 0.81 | ALDH1A1 (0.58) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL676675 | 0.81 | RECQL (0.51) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL18297669 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL4009316 | 0.81 | ALDH1A1 (0.74) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL16098128 | 0.80 | RAB9A (0.55) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL441301 | 0.79 | MAPK1 (0.51) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL768031 | 0.79 | ALDH1A1 (0.45) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT | |
| SCHEMBL31728806 | 0.79 | ALDH1A1 (0.45) | ALDH1A1MAPK1L3MBTL1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |