Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | HMOX1 | P09601 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6153207 | 1.00 | CYP19A1 (0.40) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL27672581 | 0.91 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL6152242 | 0.90 | HMOX1 (0.42) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL6152239 | 0.90 | HMOX1 (0.42) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL27672582 | 0.81 | CYP19A1 (0.38) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL28857752 | 0.81 | CYP19A1 (0.51) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| SCHEMBL27566787 | 0.81 | HMOX1 (0.41) | CYP19A1CYP11B1CYP11B2HMOX1 | |
| Hydrochloric Acid SCHEMBL6151963 | 0.79 | CYP3A4 (0.41) | CYP19A1CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL6151968 | 0.79 | CYP19A1 (0.32) | CYP19A1 | |
| SCHEMBL9667152 | 0.76 | USP2 (0.45) | CYP19A1CYP11B1CYP11B2HMOX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1068200-B1 | 2,4,4-TRISUBSTITUTED-1,3-DIOXOLANE ANTIFUNGALS | JANSSEN PHARMACEUTICA NV (BE) | 2005-02-16 | — | — | EP | disclosed |
| US-6387906-B1 | DERMATOPHYTES | JANSSEN PHARMACEUTICA N.V. (BE) | 2002-05-14 | — | — | US | disclosed |