Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.74 |
| ▸ | TSHR | P16473 | 2/20 | 0.74 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.74 |
| ▸ | HTT | P42858 | 1/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.71 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.71 |
| ▸ | MEN1 | O00255 | 5/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.70 |
| ▸ | MAPT | P10636 | 1/20 | 0.70 |
| ▸ | HPGD | P15428 | 1/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | CCKBR | P32239 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28642718 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL28662843 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL29379056 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL31310810 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL5680135 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL504399 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL18207946 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL10843678 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL1934152 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 | |
| SCHEMBL4762341 | 1.00 | KDM4E (0.74) | KDM4ETSHRHSD17B10HTTCYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108948001-A | The synthetic route of 1R, 3S-1- methyl tetrahydro-beta-carboline -3- carboxylic acid, anti-thrombus activity and application | 首都医科大学 | 2018-12-07 | — | — | CN | claimed |
| EP-2332539-A1 | PHARMACEUTICAL PREPARATION, FOOD OR BEVERAGE HAVING INHIBITORY ACTIVITY ON SEROTONIN TRANSPORTER | Suntory Holdings Limited (JP) | 2011-06-15 | — | — | EP | claimed |
| CN-108948001-A | The synthetic route of 1R, 3S-1- methyl tetrahydro-beta-carboline -3- carboxylic acid, anti-thrombus activity and application | 首都医科大学 | 2018-12-07 | — | — | CN | disclosed |
| CN-107686482-A | New heptacyclic compound, it is synthesized, activity rating and application | 首都医科大学 | 2018-02-13 | — | — | CN | disclosed |
| WO-2004113336-A1 | CARBOLINE AND BETACARBOLINE DERIVATIVES FOR USE AS HDAC ENZYME INHIBITORS | CHROMA THERAPEUTICS LIMITED (GB) | 2004-12-29 | — | — | WO | disclosed |