Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CHKA | P35790 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | NCF1 | P14598 | 1/20 | 0.46 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL3172320 | 0.79 | CHRNB2 (0.58) | ALDH1A1KDM4ECHRNB2CHRNA4 | |
| SCHEMBL14566661 | 0.78 | MC4R (0.53) | MC4RLMNACHKAALDH1A1KDM4E | |
| SCHEMBL13778529 | 0.78 | MC4R (0.49) | MC4RLMNACHKAALDH1A1KDM4E | |
| SCHEMBL8306431 | 0.78 | CHRNB2 (0.72) | MC4RALDH1A1KDM4ECHRNB2CHRNA4 | |
| SCHEMBL20332426 | 0.77 | LMNA (0.58) | MC4RLMNACHKAALDH1A1KDM4E | |
| SCHEMBL27030980 | 0.77 | MC4R (0.52) | MC4RLMNACHKAALDH1A1KDM4E | |
| SCHEMBL12424471 | 0.77 | JAK1 (0.45) | ALDH1A1CHRNB2CHRNA4RAB9AHPGD | |
| SCHEMBL15014582 | 0.77 | ACHE (0.58) | ALDH1A1KDM4ECHRNB2CHRNA4 | |
| SCHEMBL19490801 | 0.77 | MC4R (0.56) | MC4RLMNACHKAALDH1A1KDM4E | |
| SCHEMBL112800 | 0.77 | MC4R (0.47) | MC4RLMNACHKAALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023229380-A1 | HETEROCYCLIC COMPOUND AS DIACYLGLYCEROL KINASE INHIBITOR AND USE THEREOF | 주식회사 엘지화학 | 2023-11-30 | — | — | WO | disclosed |
| CN-110234652-A | Benzimidazole derivative and preparation method and application thereof | 贝达药业股份有限公司 | 2019-09-13 | — | — | CN | disclosed |