Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.43 |
| ▸ | PRKCA | P17252 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2647397 | 0.90 | L3MBTL1 (0.40) | ALDH1A1ABL1BCRSRCPRKCA | |
| SCHEMBL2659734 | 0.82 | ALDH1A1 (0.48) | ALDH1A1ABL1BCRSRCPRKCA | |
| SCHEMBL2645891 | 0.82 | MEN1 (0.43) | ALDH1A1ABL1BCRPRKCAL3MBTL1 | |
| SCHEMBL5755261 | 0.82 | L3MBTL1 (0.39) | ALDH1A1L3MBTL1HCAR3 | |
| SCHEMBL2647045 | 0.81 | MEN1 (0.43) | ALDH1A1ABL1BCRSRCPRKCA | |
| SCHEMBL2654269 | 0.81 | EGFR (0.46) | ALDH1A1ABL1BCRSRCPRKCA | |
| SCHEMBL2643637 | 0.79 | HCAR3 (0.51) | ALDH1A1ABCB1ABCC1NPC1HCAR3 | |
| SCHEMBL2653674 | 0.79 | DHODH (0.47) | ALDH1A1ABL1BCRSRCPRKCA | |
| SCHEMBL2643462 | 0.75 | MEN1 (0.54) | ALDH1A1L3MBTL1HCAR3 | |
| SCHEMBL8224805 | 0.74 | ABCB1 (0.49) | ABL1BCRSRCABCB1ABCC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0821683-B1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A RECEPTOR COMPLEX | NEUROSEARCH AS (DK) | 2006-11-02 | — | — | EP | disclosed |
| US-5902813-A | MODULATORS OF THE BENZODIAXEPINE RECEPTOR OT THE GAMMA-BUTYRIC ACID(A) RECEPTOR COMPLEX; ANXIOLYTIC, ANTIEPILEPTIC AND -CONVULSANT AGENTS; SLEEP AND MEMORY DISORDERS | NEUROSEARCH A/S (DK) | 1999-05-11 | — | — | US | disclosed |
| EP-0821683-A1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A? RECEPTOR COMPLEX | NEUROSEARCH A/S (DK) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033192-A1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABAA RECEPTOR COMPLEX | NEUROSEARCH A/S (DK) | 1996-10-24 | — | — | WO | disclosed |