Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.43 |
| ▸ | F13A1 | P00488 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | TGM1 | P22735 | 1/20 | 0.42 |
| ▸ | TGM3 | Q08188 | 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 | |
|---|---|---|---|---|
| SCHEMBL4764235 | 1.00 | ALDH1A1 (0.49) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL330988 | 0.90 | ALDH1A1 (0.49) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL330987 | 0.90 | ALDH1A1 (0.49) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL4769852 | 0.89 | MALT1 (0.50) | ALDH1A1NPC1MEN1KMT2AMAPT | |
| SCHEMBL4769848 | 0.89 | MALT1 (0.50) | ALDH1A1NPC1MEN1KMT2AMAPT | |
| SCHEMBL30968029 | 0.86 | MEN1 (0.46) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL4790229 | 0.81 | ALDH1A1 (0.65) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL4790228 | 0.81 | ALDH1A1 (0.65) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL29992015 | 0.80 | ALDH1A1 (0.69) | ALDH1A1NPC1MEN1KMT2AHTT | |
| SCHEMBL6150928 | 0.79 | LMNA (0.50) | ALDH1A1NPC1MEN1KMT2AHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1881975-A1 | N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-01-30 | — | — | EP | disclosed |
| WO-2006121218-A1 | N,N-SUBSTITUTED 3-AMINOPYRROLIDINE COMPOUNDS USEFUL AS MONOAMINES REUPTAKE INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2006-11-16 | — | — | WO | disclosed |