Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18909765 | 0.87 | CA1 (0.41) | MEN1KMT2ATSHRCA1CA2 | |
| SCHEMBL18959742 | 0.83 | CA1 (0.40) | MEN1KMT2ACA1CA2ACHE | |
| SCHEMBL19361589 | 0.82 | CYP1A2 (0.46) | MEN1KMT2ATSHRCA1CA2 | |
| SCHEMBL18914371 | 0.80 | TSHR (0.41) | MEN1KMT2ATSHRCA1CA2 | |
| SCHEMBL23095064 | 0.75 | CA1 (0.46) | MEN1KMT2ATSHRCA1CA2 | |
| SCHEMBL18893195 | 0.75 | CA1 (0.46) | MEN1KMT2ATSHRCA1CA2 | |
| SCHEMBL18909763 | 0.73 | TAS1R3 (0.39) | MEN1KMT2ASLC6A4 | |
| SCHEMBL18909753 | 0.73 | TAS1R3 (0.39) | MEN1KMT2ASLC6A4 | |
| SCHEMBL27557999 | 0.72 | ABCB1 (0.49) | MEN1KMT2ARECQLABCB1POLB | |
| SCHEMBL27555727 | 0.71 | ABCB1 (0.48) | ABCB1NPSR1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017091602-A1 | ESTER ACC INHIBITORS AND USES THEREOF | GILEAD APOLLO, LLC (US) | 2017-06-01 | — | — | WO | disclosed |
| WO-2017091600-A1 | PYRAZOLE ACC INHIBITORS AND USES THEREOF | GILEAD APOLLO, LLC (US) | 2017-06-01 | — | — | WO | disclosed |