Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.66 |
| ▸ | RAB9A | P51151 | 8/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 5/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.66 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 5/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.61 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.61 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL4687191 | 0.88 | NPC1 (0.52) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL20788543 | 0.87 | NPC1 (0.77) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL11222516 | 0.86 | NPC1 (0.62) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL2608447 | 0.86 | ATAD2 (0.63) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL77451 | 0.84 | ATAD2 (0.61) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL6475970 | 0.84 | ATAD2 (0.61) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL3610148 | 0.82 | FFAR2 (0.51) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL77851 | 0.81 | FFAR2 (0.62) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL77628 | 0.81 | ALDH1A1 (0.64) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL77497 | 0.81 | NPC1 (0.65) | NPC1RAB9AKMT2AALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-60011479-A | — | — | None | — | — | JP | disclosed |
| WO-2024235205-A1 | THIAZOLE DERIVATIVE INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-11-21 | — | — | WO | disclosed |
| CN-109563120-B | alpha-D-galactoside inhibitors of galectins | 格莱克特生物技术公司 | 2022-12-02 | — | — | CN | disclosed |
| WO-2010103381-A1 | SPIROCYCLIC PIPERIDINE DERIVATIVES AS TRPM 8 MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2010-09-16 | — | — | WO | disclosed |
| JP-S6011479-A | THIAZOLYLCARBAMATE COMPOUND AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE | SHOWA DENKO KK | 1985-01-21 | — | — | JP | disclosed |