Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 10/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8535868 | 0.97 | TSHR (0.49) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8536251 | 0.85 | TSHR (0.59) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8535859 | 0.82 | TSHR (0.55) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8538506 | 0.80 | TSHR (0.65) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8538378 | 0.75 | TSHR (0.64) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL9025866 | 0.74 | LMNA (0.67) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8982030 | 0.71 | TSHR (0.47) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8539849 | 0.71 | TSHR (0.74) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 | |
| SCHEMBL5355585 | 0.70 | MAPT (0.50) | TSHRCYP3A4CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17486078 | 0.67 | TSHR (0.54) | TSHRMAPK1CYP3A4CYP2D6CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0629622-B1 | S-TRIAZINE DERIVATIVE AND REMEDY FOR ESTROGEN-DEPENDENT DISEASES CONTAINING THE SAME AS ACTIVE INGREDIENT | ZENYAKU KOGYO KK (JP) | 1998-11-11 | — | — | EP | disclosed |
| US-5489591-A | INHIBITORS OF AROMATASE; TREATING ENDOMETRIOSIS, BREAST CANCER CYSTIC OVARIES | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1996-02-06 | — | — | US | disclosed |
| EP-0629622-A1 | s-TRIAZINE DERIVATIVE AND REMEDY FOR ESTROGEN-DEPENDENT DISEASES CONTAINING THE SAME AS ACTIVE INGREDIENT | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1994-12-21 | — | — | EP | disclosed |