Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL467441 | 0.72 | RAB9A (0.50) | NPC1RAB9AALDH1A1MAPTHSD17B10 | |
| SCHEMBL6336392 | 0.71 | RAB9A (0.53) | NPC1RAB9AALDH1A1MAPTHSD17B10 | |
| SCHEMBL11785225 | 0.70 | ALDH1A1 (0.38) | NPC1RAB9AALDH1A1MAPTHSD17B10 | |
| SCHEMBL8588800 | 0.67 | ALDH1A1 (0.40) | NPC1RAB9AALDH1A1MAPTHSD17B10 | |
| SCHEMBL1388471 | 0.67 | ALDH1A1 (0.35) | ALDH1A1MAPTHSD17B10CYP3A4PSMB8 | |
| SCHEMBL29547 | 0.67 | AHR (0.37) | ALDH1A1MAPTHSD17B10CYP3A4PSMB8 | |
| SCHEMBL7288684 | 0.67 | ALDH1A1 (0.35) | ALDH1A1MAPTHSD17B10CYP3A4PSMB8 | |
| SCHEMBL7288961 | 0.67 | ALDH1A1 (0.35) | NPC1RAB9AALDH1A1MAPTHSD17B10 | |
| SCHEMBL4466423 | 0.67 | ALDH1A1 (0.35) | ALDH1A1MAPTHSD17B10CYP3A4PSMB8 | |
| SCHEMBL1388411 | 0.67 | ALDH1A1 (0.35) | ALDH1A1MAPTHSD17B10CYP3A4PSMB8 |
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-3416963-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | Global Blood Therapeutics, Inc. (US) | 2018-12-26 | — | — | EP | disclosed |
| WO-2017142947-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | GLOBAL BLOOD THERAPEUTICS, INC. (US) | 2017-08-24 | — | — | WO | disclosed |
| EP-2720545-A1 | CYCLOALKYL-FUSED TETRAHYDROQUINOLINES AS CRTH2 RECEPTOR MODULATORS | Merck Sharp & Dohme Corp. (US) | 2014-04-23 | — | — | EP | disclosed |
| WO-2012174176-A1 | CYCLOALKYL-FUSED TETRAHYDROQUINOLINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME CORP. (US) | 2012-12-20 | — | — | WO | disclosed |