Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.46 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9729576 | 0.85 | ACP3 (0.46) | CYP1A2SLC6A2SLC6A4ALDH1A1MEN1 | |
| SCHEMBL3907301 | 0.84 | CYP19A1 (0.41) | CYP19A1CYP11B1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6503338 | 0.84 | CYP19A1 (0.62) | CYP19A1CYP3A4SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3903975 | 0.81 | CYP11B1 (0.44) | CYP19A1CYP11B1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3652018 | 0.81 | CYP19A1 (0.46) | CYP19A1KCNA5CYP3A4SLC6A2SLC6A4 | |
| Bromide SCHEMBL11274115 | 0.80 | KCNA5 (0.41) | CYP19A1KCNA5CYP11B1CYP1A1CYP1A2 | |
| SCHEMBL1515745 | 0.80 | ACP3 (0.50) | TRPM8ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL360712 | 0.80 | CFTR (0.57) | CYP19A1KCNA5CYP11B1SLC6A2SLC6A4 | |
| SCHEMBL21778081 | 0.78 | ACP3 (0.41) | CYP1A2ALDH1A1MEN1KMT2AOPRM1 | |
| SCHEMBL11152058 | 0.78 | ACP3 (0.41) | CYP1A2ALDH1A1MEN1KMT2AOPRM1 |
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-20050080113-A1 | Medicinal compositions | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-04-14 | — | — | 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-20050080113-A1 | Medicinal compositions | TNF, TRAF6, MMP8 | CYP19A1 2827/4885KCNA5 3736/4885CYP11B1 2166/4885 |
“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.