Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11229776 | 0.85 | CYP3A4 (0.33) | CYP3A4ALDH1A1 | |
| SCHEMBL9239969 | 0.81 | CES1 (0.37) | CYP3A4TSHR | |
| SCHEMBL8404973 | 0.80 | CYP3A4 (0.40) | CYP3A4TSHRALDH1A1ADRB2ADRB1 | |
| SCHEMBL9239980 | 0.75 | CYP3A4 (0.33) | CYP3A4ALDH1A1ADRB2ADRB1ADRB3 | |
| SCHEMBL5430402 | 0.75 | CYP3A4 (0.33) | CYP3A4TSHRALDH1A1ADRB2ADRB1 | |
| SCHEMBL3337106 | 0.72 | CYP3A4 (0.34) | CYP3A4TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL3337724 | 0.72 | CYP3A4 (0.34) | CYP3A4TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL11012630 | 0.72 | CYP3A4 (0.34) | CYP3A4TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL15106760 | 0.72 | CYP3A4 (0.34) | CYP3A4TSHRADRB2ADRB1ADRB3 | |
| SCHEMBL7565088 | 0.72 | CYP3A4 (0.34) | CYP3A4TSHRADRB2ADRB1ADRB3 |
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-4360647-A | Phosphonate terminated dicyclopentadiene modified polyesters | THE DOW CHEMICAL COMPANY (US) | 1982-11-23 | — | — | US | claimed |