Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 17/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6428991 | 0.79 | NOTUM (0.44) | NOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL28858824 | 0.77 | NOTUM (0.49) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL3387244 | 0.76 | NOTUM (0.53) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL1586174 | 0.76 | TSHR (0.43) | NOTUMHCRTR1HCRTR2KEAP1CYP1A2 | |
| SCHEMBL27883271 | 0.76 | ALDH1A1 (0.43) | NOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL27883266 | 0.76 | HCRTR1 (0.54) | NOTUMHCRTR1HCRTR2KEAP1CYP2C9 | |
| SCHEMBL1586907 | 0.74 | HCRTR1 (0.53) | NOTUMHCRTR1HCRTR2CYP1A2CYP2C9 | |
| SCHEMBL1042222 | 0.73 | NOTUM (0.42) | NOTUMHCRTR1HCRTR2 | |
| SCHEMBL17910085 | 0.73 | HCRTR1 (0.52) | NOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL30721401 | 0.73 | NOTUM (0.45) | NOTUMCYP1A2CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-8722592-B2 | Use of triazoles in reducing cobalt leaching from cobalt-containing metal working tools | Wincom, Inc. (US) | 2014-05-13 | — | — | US | disclosed |
| US-20100022424-A1 | USE OF TRIAZOLES IN REDUCING COBALT LEACHING FROM COBALT-CONTAINING METAL WORKING TOOLS | Wincom, Inc. (US) | 2010-01-28 | — | — | US | disclosed |