Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15526430 | 0.78 | SLC22A12 (0.32) | SMN1; SMN2KDM4ENPC1RAB9ADHODH | |
| SCHEMBL15526431 | 0.78 | SLC22A12 (0.32) | SMN1; SMN2KDM4ENPC1RAB9ADHODH | |
| SCHEMBL15333587 | 0.77 | CYP3A4 (0.39) | SMN1; SMN2L3MBTL1KDM4ETP53MDM2 | |
| SCHEMBL15333588 | 0.77 | CYP3A4 (0.39) | SMN1; SMN2L3MBTL1KDM4ETP53MDM2 | |
| SCHEMBL15331460 | 0.75 | CYP3A4 (0.48) | SMN1; SMN2KDM4ENPC1RAB9ASLC22A12 | |
| SCHEMBL13735898 | 0.74 | EGFR (0.35) | SMN1; SMN2TP53MDM2MAPTNPC1 | |
| SCHEMBL19894349 | 0.74 | KMO (0.34) | SMN1; SMN2KDM4ENPC1RAB9ASLC22A12 | |
| SCHEMBL15331869 | 0.74 | ABL1 (0.39) | — | |
| SCHEMBL17446789 | 0.73 | CYP3A4 (0.37) | L3MBTL1NPC1RAB9ATDP1 | |
| SCHEMBL15526296 | 0.73 | CYP3A4 (0.38) | SMN1; SMN2L3MBTL1KDM4EALDH1A1MAPT |
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-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 |