Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976426 | 0.88 | TSHR (0.45) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL13044308 | 0.87 | TSHR (0.44) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL19789660 | 0.83 | LMNA (0.41) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL404326 | 0.80 | LMNA (0.42) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL1929190 | 0.79 | TSHR (0.58) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL19976411 | 0.79 | BCHE (0.46) | TSHRLMNAALDH1A1BCHE | |
| SCHEMBL7152281 | 0.79 | TSHR (0.61) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL9522969 | 0.77 | TSHR (0.51) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL10429257 | 0.77 | TSHR (0.51) | TSHRLMNAALDH1A1KMT2ACYP2D6 | |
| SCHEMBL402667 | 0.77 | ALDH1A1 (0.39) | TSHRALDH1A1CYP3A4MAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2084172-B1 | NOVEL 1,4-BENZOTHIEPIN-1,1-DIOXIDE DERIVATIVES WHICH ARE SUBSTITUTED WITH BENZYL GROUPS, METHOD FOR PRODUCING DRUGS CONTAINING SAID COMPOUNDS AND USE THEREOF | SANOFI AVENTIS DEUTSCHLAND (DE) | 2010-12-22 | — | — | EP | disclosed |