Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL909638 | 0.87 | TSHR (0.52) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL3898476 | 0.87 | TSHR (0.58) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL909296 | 0.79 | TSHR (0.45) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL7274798 | 0.79 | TSHR (0.50) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL58502 | 0.78 | TSHR (0.48) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL909497 | 0.78 | ALDH1A1 (0.47) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL7269560 | 0.78 | TSHR (0.48) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL4192218 | 0.75 | HTT (0.47) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL909695 | 0.73 | VCAM1 (0.48) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 | |
| SCHEMBL11577751 | 0.73 | TSHR (0.39) | TSHRCYP19A1ALDH1A1CYP3A4TDP1 |
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-3070081-A1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | Gilead Sciences, Inc. (US) | 2016-09-21 | — | — | EP | disclosed |
| EP-2788336-A1 | BENZOTHIAZOL- 6 -YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | Gilead Sciences, Inc. (US) | 2014-10-15 | — | — | EP | disclosed |
| WO-2013159064-A1 | BENZOTHIAZOL- 6 -YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | GILEAD SCIENCES, INC. (US) | 2013-10-24 | — | — | WO | disclosed |