Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL25528978 | 0.82 | TSHR (0.57) | RAB9AHPGDHSD17B10LMNAMAPK1 | |
| SCHEMBL3122553 | 0.82 | SMN1; SMN2 (0.54) | HPGDHTTHSD17B10LMNAMAPK1 | |
| SCHEMBL7565510 | 0.79 | RAB9A (0.71) | NPC1RAB9AHPGDCYP1A2CYP2C9 | |
| SCHEMBL190015 | 0.76 | CA12 (0.45) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL190346 | 0.75 | — | — | |
| SCHEMBL11767621 | 0.75 | KDM4E (0.70) | NPC1RAB9AHPGDCYP1A2CYP2C9 | |
| Ethyl Phenylcarbamate SCHEMBL264865 | 0.74 | RAB9A (0.75) | NPC1RAB9AHPGDCYP2C9CYP2C19 | |
| SCHEMBL7565512 | 0.74 | RAB9A (0.70) | NPC1RAB9AHPGDCYP1A2CYP2C9 | |
| Ethyl Phenylcarbamate SCHEMBL11593824 | 0.74 | RAB9A (0.75) | NPC1RAB9AHPGDCYP2C9CYP2C19 | |
| SCHEMBL9146676 | 0.74 | LMNA (0.68) | NPC1RAB9AHPGDCYP1A2CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2947084-B1 | FIVE-AND-SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | GUANGZHOU MAXINOVEL PHARMACEUTICALS CO (CN) | 2020-09-23 | — | — | EP | disclosed |