Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11622233 | 0.81 | CYP2D6 (0.49) | SLC6A2SLC6A4ALDH1A1ABCC1LTB4R2 | |
| SCHEMBL11618155 | 0.78 | SLC6A2 (0.57) | SLC6A2SLC6A4ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL11619592 | 0.77 | NPSR1 (0.47) | SLC6A2SLC6A4ALDH1A1L3MBTL1NPSR1 | |
| SCHEMBL11258642 | 0.74 | CYP2D6 (0.49) | SLC6A2SLC6A4ALDH1A1NPSR1KMT2A | |
| SCHEMBL11623001 | 0.74 | HSD11B1 (0.51) | SLC6A2SLC6A4ALDH1A1NPSR1KMT2A | |
| SCHEMBL808482 | 0.74 | G6PD (0.57) | ALDH1A1G6PDCASP7CASP6LMNA | |
| SCHEMBL30762619 | 0.74 | G6PD (0.57) | ALDH1A1G6PDCASP7CASP6LMNA | |
| SCHEMBL11266475 | 0.73 | CYP2D6 (0.48) | SLC6A2SLC6A4ALDH1A1NPSR1KMT2A | |
| Hydrochloric Acid SCHEMBL11260268 | 0.73 | LMNA (0.50) | SLC6A2SLC6A4ALDH1A1NPSR1KMT2A | |
| SCHEMBL11649382 | 0.72 | CYP2D6 (0.55) | SLC6A2SLC6A4ALDH1A1NPSR1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE29628-E | ANTIULCER, SECRETOLYTICS, ANTITUSSIVE | BOEHRINGER INGELHEIM GMBH (DT) | 1978-05-09 | — | — | US | disclosed |
| US-4006246-A | ANTIULCER, SECRETOLYTIC, ANTITUSSIVE, STIMULANT | BOEHRINGER INGELHEIM GMBH (DT) | 1977-02-01 | — | — | US | disclosed |
| US-3950393-A | ANTIULCER, ANTISECRETORY, ANTITUSSIVE AGENTS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-04-13 | — | — | US | disclosed |