Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | CALCA | P06881 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | SLC22A2 | O15244 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL52819 | 0.94 | CYP2C9 (0.38) | CYP2C9KCNH2TRPV1P2RX7CALCA | |
| SCHEMBL52371 | 0.86 | KDM1A (0.35) | TRPV1P2RX7 | |
| SCHEMBL52565 | 0.84 | CYP2C9 (0.40) | CYP2C9KCNH2TRPV1P2RX7SLC22A2 | |
| SCHEMBL52802 | 0.81 | CYP2C9 (0.39) | CYP2C9KCNH2TRPV1P2RX7 | |
| SCHEMBL52158 | 0.81 | CYP2C9 (0.39) | CYP2C9KCNH2P2RX7CALCASLC22A2 | |
| SCHEMBL52370 | 0.81 | KDM1A (0.34) | TRPV1P2RX7CALCA | |
| SCHEMBL53230 | 0.80 | CYP2C9 (0.37) | CYP2C9KCNH2P2RX7 | |
| SCHEMBL13691740 | 0.79 | CYP2C9 (0.42) | CYP2C9KCNH2TRPV1P2RX7SLC22A2 | |
| SCHEMBL51960 | 0.78 | KCNH2 (0.54) | CYP2C9KCNH2CALCALIPG | |
| SCHEMBL53085 | 0.72 | KCNH2 (0.43) | CYP2C9KCNH2CALCA |
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-8129398-B2 | HIV integrase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-06 | — | — | US | disclosed |
| US-20090253677-A1 | HIV Integrase Inhibitors | BRISTOL-MYERS SQUIBB COMPANY | 2009-10-08 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20090253677-A1 | HIV Integrase Inhibitors | DNTT, POLB, UNG | CYP2C9 602/4885KCNH2 3969/4885TRPV1 4767/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.