Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NEK2 | P51955 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30915761 | 1.00 | KDM4E (0.46) | KDM4ECYP2C19NEK2ADRA1AADRA1D | |
| Hydrochloric Acid SCHEMBL8985222 | 0.98 | KDM4E (0.45) | KDM4ECYP2C19NEK2ADRA1AADRA1D | |
| SCHEMBL24493549 | 0.81 | KDM4E (0.47) | KDM4EADRA1AL3MBTL1LMNA | |
| Hydrochloric Acid SCHEMBL16340766 | 0.80 | KDM4E (0.46) | KDM4EADRA1AL3MBTL1LMNA | |
| SCHEMBL8985203 | 0.78 | CYP2C19 (0.46) | KDM4ECYP2C19L3MBTL1HPGDNPSR1 | |
| SCHEMBL32672096 | 0.78 | ADRA1A (0.39) | ADRA1AADRA1DHTR5AADRA2A | |
| SCHEMBL24493257 | 0.75 | ADRA1A (0.41) | ADRA1AADRA1DADRA1BHTR5AADRA2A | |
| SCHEMBL21231348 | 0.75 | CHRM1 (0.40) | KDM4EADRA1AL3MBTL1LMNAHTT | |
| Bromide SCHEMBL32671883 | 0.74 | ADRA1A (0.40) | ADRA1AADRA1DADRA1BHTR5AADRA2A | |
| SCHEMBL31132566 | 0.73 | KDM4E (0.42) | KDM4ECYP2C19NEK2L3MBTL1USP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025108255-A1 | POLYCYCLIC DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海齐鲁制药研究中心有限公司 | 2025-05-30 | — | — | WO | disclosed |
| CN-114929697-A | Azabenzimidazole compounds and medicaments | 日本新药株式会社 | 2022-08-19 | — | — | CN | disclosed |
| EP-3080110-B1 | TETRAHYDROIMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY | UCB BIOPHARMA SPRL (BE) | 2019-07-10 | — | — | EP | disclosed |
| US-8980888-B2 | Pyrazole derivative | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2015-03-17 | — | — | US | disclosed |
| US-5336679-A | Treatment of irritable bowel syndrome | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1994-08-09 | — | — | US | disclosed |