Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.60 |
| ▸ | CA1 | P00915 | 3/20 | 0.60 |
| ▸ | CA2 | P00918 | 3/20 | 0.60 |
| ▸ | CA9 | Q16790 | 3/20 | 0.60 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.60 |
| ▸ | APP | P05067 | 3/20 | 0.59 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL20511434 | 0.89 | HPGD (0.62) | CA12CA1CA2CA9CA14 | |
| SCHEMBL10851721 | 0.88 | HPGD (0.56) | CA12CA1CA2CA9CA14 | |
| SCHEMBL22151175 | 0.86 | APP (0.64) | APPKCNH3BCHEACHEL3MBTL1 | |
| SCHEMBL7024590 | 0.84 | APP (0.54) | APPKCNH3BCHEACHEL3MBTL1 | |
| SCHEMBL1309478 | 0.84 | CA12 (0.59) | CA12CA1CA2CA9CA14 | |
| SCHEMBL1562297 | 0.82 | APP (0.59) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6673861 | 0.82 | APP (0.47) | CA12CA1CA2CA9CA14 | |
| SCHEMBL6674407 | 0.82 | CA9 (0.61) | CA12CA1CA2CA9CA14 | |
| SCHEMBL1312011 | 0.82 | PKM (0.66) | CA12CA1CA2CA9CA14 | |
| SCHEMBL8347870 | 0.80 | HDAC1 (0.56) | CA12CA1CA2CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108191774-B | Heterocyclic compound, preparation method and application thereof | 中国药科大学 | 2022-05-24 | — | — | CN | disclosed |
| WO-2020146779-A1 | mTORC1 INHIBITORS FOR ACTIVATING AUTOPHAGY | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-07-16 | — | — | WO | disclosed |
| WO-2018175958-A1 | THIOREDOXIN MODULATORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2018-09-27 | — | — | WO | disclosed |
| WO-2004035199-A1 | AFFINITY ADSORBENTS FOR IMMUNOGLOBULINS | CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) | 2004-04-29 | — | — | WO | disclosed |