Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 11/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2511323 | 0.68 | NPC1 (0.61) | NOTUMKEAP1KDM4EALDH1A1KMT2A | |
| SCHEMBL27659680 | 0.66 | NOTUM (0.41) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL23058908 | 0.66 | TNF (0.48) | AHRKEAP1PDPK1CCNE2CDK4 | |
| SCHEMBL16681120 | 0.65 | PDPK1 (0.49) | NOTUMKEAP1KDM4EPDPK1CDK2 | |
| SCHEMBL10463767 | 0.64 | AHR (0.48) | AHRKEAP1ALDH1A1PDPK1CYP1A2 | |
| SCHEMBL2048674 | 0.64 | NOTUM (0.48) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL10463771 | 0.64 | AHR (0.70) | AHRKEAP1KDM4EALDH1A1KMT2A | |
| SCHEMBL16719842 | 0.64 | AHR (0.48) | AHRKEAP1KDM4EALDH1A1PDPK1 | |
| SCHEMBL18416512 | 0.64 | LMNA (0.52) | AHRKDM4EALDH1A1KMT2A | |
| SCHEMBL22702085 | 0.63 | NOTUM (0.47) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4959479-A | PESTICIDES, DRUGS | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1990-09-25 | — | — | US | claimed |
| US-4959479-A | PESTICIDES, DRUGS | AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) | 1990-09-25 | — | — | US | disclosed |
| US-4889937-A | MEDICINES, PESTICIDES AND INDUSTRIAL CHEMICALS | AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 1989-12-26 | — | — | US | disclosed |