Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 13/20 | 0.80 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | CCR1 | P32246 | 3/20 | 0.40 |
| ▸ | CCR2 | P41597 | 3/20 | 0.40 |
| ▸ | CCR4 | P51679 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 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 | |
|---|---|---|---|---|
| SCHEMBL29820095 | 0.92 | CYP19A1 (0.69) | CYP19A1CCR1CCR2CCR4IDO1 | |
| SCHEMBL4564456 | 0.92 | CYP19A1 (0.69) | CYP19A1HTR1AIDO1TDO2 | |
| SCHEMBL29820189 | 0.90 | CYP19A1 (0.67) | CYP19A1HTR1ACCR1CCR2CCR4 | |
| SCHEMBL3153071 | 0.90 | CYP19A1 (0.67) | CYP19A1HTR1A | |
| SCHEMBL16129814 | 0.90 | CYP19A1 (0.67) | CYP19A1HTR1A | |
| SCHEMBL10194241 | 0.90 | CYP19A1 (0.67) | CYP19A1HTR1AIDO1 | |
| SCHEMBL6881194 | 0.90 | CYP19A1 (0.67) | CYP19A1HTR1ACCR1CCR2CCR4 | |
| SCHEMBL155247 | 0.89 | CYP19A1 (1.00) | CYP19A1CCR1CCR2 | |
| Hydrochloric Acid SCHEMBL7263772 | 0.87 | CYP19A1 (0.96) | CYP19A1CCR1CCR2 | |
| SCHEMBL31286294 | 0.87 | CYP19A1 (0.62) | CYP19A1HTR1A |
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-7772358-B2 | Polytriazoles constructed by 1,3-dipolar cycloaddition | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2010-08-10 | — | — | US | disclosed |
| US-20080103273-A1 | Polytriazoles constructed by 1, 3-dipolar cycloaddition | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2008-05-01 | — | — | US | disclosed |
| US-20080103273-A1 | Polytriazoles constructed by 1, 3-dipolar cycloaddition | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2008-05-01 | — | — | US | disclosed |