Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6319237 | 0.87 | KMT2A (0.48) | TSHRKMT2AMEN1CYP3A4CYP1A2 | |
| SCHEMBL6322567 | 0.85 | TSHR (0.44) | TSHRMAPTKMT2AMEN1CYP3A4 | |
| SCHEMBL1544595 | 0.82 | KCNH2 (0.46) | TSHRSMPD1MAPTL3MBTL1KMT2A | |
| SCHEMBL1544935 | 0.81 | CYP3A4 (0.57) | TSHRMAPTKMT2AMEN1CYP3A4 | |
| SCHEMBL1544505 | 0.81 | TSHR (0.48) | TSHRSMPD1MAPTTDP1L3MBTL1 | |
| SCHEMBL1544099 | 0.81 | TSHR (0.59) | TSHRMAPTKMT2AMEN1CYP3A4 | |
| SCHEMBL1543990 | 0.80 | TSHR (0.56) | TSHRMAPTKMT2AMEN1CYP3A4 | |
| Pyridine SCHEMBL1545165 | 0.79 | KCNH2 (0.47) | TSHRSMPD1MAPTKMT2AMEN1 | |
| SCHEMBL1543761 | 0.79 | CYP3A4 (0.55) | TSHRKMT2AMEN1CYP3A4CYP1A2 | |
| SCHEMBL1543717 | 0.78 | TSHR (0.50) | TSHRMAPTTDP1L3MBTL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1529045-A2 | NEW COMPOUNDS | Astra Zeneca AB (SE) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004014881-A2 | '1,2,4'OXADIAZOLES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | ASTRA ZENECA AB (SE) | 2004-02-19 | — | — | WO | disclosed |