Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA6 | P23280 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | RXRB | P28702 | 1/20 | 0.45 |
| ▸ | RXRG | P48443 | 1/20 | 0.45 |
| ▸ | KYNU | Q16719 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | BCL2 | P10415 | 1/20 | 0.42 |
| ▸ | GALR3 | O60755 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16428925 | 0.87 | ANPEP (0.53) | CA12CA1CA2CA6CA9 | |
| SCHEMBL25210900 | 0.85 | CYP17A1 (0.55) | CYP17A1CA12CA2CA9SLC22A1 | |
| SCHEMBL27344332 | 0.85 | LMNA (0.50) | LMNAHSD17B10RXRARXRBRXRG | |
| SCHEMBL27514771 | 0.85 | SLC22A1 (0.57) | CYP17A1CA12CA2CA9SLC22A1 | |
| Terephthalic Acid SCHEMBL8675145 | 0.83 | DRD1 (0.61) | CA12CA1CA2CA6CA9 | |
| SCHEMBL9397957 | 0.83 | CPN1 (0.48) | CA1CA2CA9LMNAHSD17B10 | |
| SCHEMBL938192 | 0.83 | ALDH1A1 (0.56) | CA12CA1CA2CA6CA9 | |
| SCHEMBL28546016 | 0.82 | CA12 (0.50) | CYP17A1CA12CA1CA2CA9 | |
| Isophthalic Acid SCHEMBL8664124 | 0.81 | CA12 (0.52) | CYP17A1CA12CA1CA2CA6 | |
| Benzoic Acid SCHEMBL28247779 | 0.80 | LMNA (0.54) | CA12CA1CA2CA6CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5276184-A | Curing agents for epoxy resins for thermosetting resins | THE DOW CHEMICAL COMPANY (US) | 1994-01-04 | — | — | US | disclosed |