Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL10918542 | 0.82 | TSHR (0.71) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL6979279 | 0.81 | TSHR (0.57) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL24622615 | 0.78 | ALDH1A1 (0.58) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL29768852 | 0.78 | ALDH1A1 (0.58) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL29864638 | 0.77 | TSHR (0.65) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL5250015 | 0.77 | TSHR (0.65) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL6978733 | 0.77 | TSHR (0.49) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL1473759 | 0.77 | ALDH1A1 (0.47) | TSHRLMNACYP1A2ALDH1A1MAPK1 | |
| SCHEMBL10651848 | 0.76 | TSHR (0.62) | TSHRLMNACYP19A1CYP1A2CYP2D6 | |
| SCHEMBL6979276 | 0.75 | TSHR (0.53) | TSHRLMNACYP19A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1222511-C | I-aryl-or-I-alkylsulfonyl-heterocyclylbenzazoles as 5-hydroxytryptamine-b ligands | WYETH CO (US) | 2005-10-12 | — | — | CN | disclosed |
| CN-1484638-A | I-aryl-or-I-alkylsulfonyl-heterocyclylbenzazoles as 5-hydroxytryptamine-b ligands | — | 2004-03-24 | — | — | CN | disclosed |
| EP-1343756-A2 | 1-ARYL- OR 1-ALKYLSULFONYL-HETEROCYCLYLBENZAZOLES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS | Wyeth (US) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002036562-A2 | 1-ARYL- OR 1-ALKYLSULFONYL-HETEROCYCLYLBENZAZOLES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS | WYETH (US) | 2002-05-10 | — | — | WO | disclosed |