Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.32 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13207110 | 0.82 | ALDH1A1 (0.31) | — | |
| SCHEMBL13207111 | 0.82 | — | — | |
| SCHEMBL18897494 | 0.79 | NOS3 (0.39) | TSHRCYP1A2CYP2C19GPR35 | |
| SCHEMBL27461874 | 0.77 | TSHR (0.35) | TSHRHTR6 | |
| SCHEMBL4089661 | 0.75 | TSHR (0.38) | TSHRHTR6NUDT1 | |
| SCHEMBL27792500 | 0.74 | TSHR (0.33) | TSHRHTR6 | |
| SCHEMBL27464483 | 0.74 | HTR6 (0.36) | TSHRHTR6NUDT1 | |
| SCHEMBL27583259 | 0.74 | TSHR (0.33) | TSHRHTR6 | |
| SCHEMBL10965241 | 0.74 | ALDH1A1 (0.34) | TSHRHTR6 | |
| SCHEMBL26281387 | 0.74 | EZH2 (0.38) | TSHRCYP1A2CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5025005-A | Preventive or therapeutic agents for circulatory diseases, allergic disorders; antineoplastic agent; inhibitor for platelet activating factor | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-06-18 | — | — | US | disclosed |
| US-4778912-A | ANTITUMOR AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1988-10-18 | — | — | US | disclosed |
| US-4565865-A | ANTITUMOR AGENTS, MICROBIOCIDES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-01-21 | — | — | US | disclosed |
| EP-0035375-B1 | CARBAMIC ACID ESTERS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1983-08-10 | — | — | EP | disclosed |