Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | UGCG | Q16739 | 1/20 | 0.39 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | AGXT | P21549 | 2/20 | 0.37 |
| ▸ | GYPA | P02724 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10565538 | 0.85 | PDE4D (0.52) | CA1GBA1UGCGGBA2PDE4D | |
| SCHEMBL12769971 | 0.85 | GLA (0.39) | TDP1L3MBTL1CA1CA2CHRM3 | |
| SCHEMBL8076909 | 0.83 | PDE4D (0.47) | TDP1L3MBTL1CA1CA2GBA1 | |
| SCHEMBL8076913 | 0.83 | PDE4D (0.47) | TDP1L3MBTL1CA1CA2GBA1 | |
| SCHEMBL17082370 | 0.83 | CYP3A4 (0.39) | TDP1L3MBTL1CA1CA2GLA | |
| SCHEMBL12769950 | 0.81 | GLA (0.39) | TDP1L3MBTL1CA1CA2CHRM3 | |
| SCHEMBL12769262 | 0.81 | GLA (0.39) | TDP1L3MBTL1CA1CA2CHRM3 | |
| SCHEMBL12769963 | 0.81 | HDAC4 (0.36) | TDP1L3MBTL1CHRM3GLANPSR1 | |
| SCHEMBL14212904 | 0.80 | TDP1 (0.35) | TDP1L3MBTL1CA1CA2GBA1 | |
| SCHEMBL12552190 | 0.77 | CA1 (0.37) | TDP1L3MBTL1CA1CA2PDE4D |
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 |
|---|---|---|---|---|---|---|---|
| EP-2308861-B1 | MACROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICALS | EISAI R&D MAN CO LTD (JP) | 2017-03-01 | — | — | EP | disclosed |
| EP-1507773-B1 | MACROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICALS | EISAI R&D MAN CO LTD (JP) | 2015-09-16 | — | — | EP | disclosed |
| US-7915306-B2 | For therapy of inflammatory or autoimmune disorders | EISAI CO., LTD. (JP) | 2011-03-29 | — | — | US | disclosed |
| US-7799827-B2 | Macrocyclic compounds useful as pharmaceuticals | EISAI CO., LTD. (JP) | 2010-09-21 | — | — | US | disclosed |