Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | RB1 | P06400 | 5/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9834959 | 1.00 | NR2E1 (0.53) | NR2E1GAAL3MBTL1RB1TP53 | |
| SCHEMBL7591546 | 1.00 | NR2E1 (0.53) | NR2E1GAAL3MBTL1RB1TP53 | |
| Sulfuric Acid SCHEMBL7589746 | 0.93 | NR2E1 (0.47) | NR2E1GAAL3MBTL1RB1TP53 | |
| SCHEMBL14768417 | 0.86 | VPS4B (0.51) | GAAL3MBTL1CYP2D6KCNH2HTR1A | |
| SCHEMBL2494316 | 0.86 | VPS4B (0.51) | GAAL3MBTL1CYP2D6KCNH2HTR1A | |
| SCHEMBL2494312 | 0.86 | VPS4B (0.51) | GAAL3MBTL1CYP2D6KCNH2HTR1A | |
| SCHEMBL2493068 | 0.86 | VPS4B (0.51) | GAAL3MBTL1CYP2D6KCNH2HTR1A | |
| SCHEMBL2493069 | 0.86 | VPS4B (0.51) | GAAL3MBTL1CYP2D6KCNH2HTR1A | |
| SCHEMBL4803895 | 0.81 | NR2E1 (0.61) | NR2E1GAARB1TP53HPGD | |
| SCHEMBL23875579 | 0.79 | NR2E1 (0.58) | NR2E1RB1TP53HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010078250-A1 | SYNTHESIS OF (2-AMINO)-TETRAHYDROCARBAZOLE-PROPANOIC ACID | CHIRAL QUEST, INC. (US) | 2010-07-08 | — | — | WO | disclosed |
| EP-0728743-B1 | 3-Amino-tetrahydrocarbazol propanoic acid esters | BAYER AG (DE) | 2002-10-30 | — | — | EP | disclosed |
| US-5684158-A | 3-amino!-tetrahydrocarbazole-propanoic acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1997-11-04 | — | — | US | disclosed |
| EP-0728743-A1 | 3-Amino-tetrahydrocarbazol propanoic acid esters | BAYER AG (DE) | 1996-08-28 | — | — | EP | disclosed |