Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11270472 | 0.87 | CA12 (0.45) | APEX1CA12CA9GLAKDM4E | |
| SCHEMBL11265517 | 0.87 | APEX1 (0.45) | APEX1CA12CA9GLAKDM4E | |
| SCHEMBL11279146 | 0.83 | APEX1 (0.49) | APEX1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11280487 | 0.82 | KDM4E (0.42) | APEX1CA12CA9GLAKDM4E | |
| SCHEMBL11282506 | 0.81 | ALDH1A1 (0.51) | CA12CA9KDM4EMEN1KMT2A | |
| SCHEMBL11275635 | 0.78 | APEX1 (0.45) | APEX1CA12CA9GLAKDM4E | |
| SCHEMBL11275890 | 0.78 | ALDH1A1 (0.51) | APEX1CA12CA9GLAKDM4E | |
| SCHEMBL11275631 | 0.75 | KDM4E (0.38) | APEX1CA12CA9KDM4EMEN1 | |
| SCHEMBL14584130 | 0.71 | CYP1A2 (0.40) | KMT2ACYP3A4 | |
| SCHEMBL11277993 | 0.71 | ALDH1A1 (0.52) | CA12CA9KDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4337265-A | COMPLICATIONS OF DIABETES | AYERST, MCKENNA & HARRISON INC. (CA) | 1982-06-29 | — | — | US | claimed |
| US-4337265-A | COMPLICATIONS OF DIABETES | AYERST, MCKENNA & HARRISON INC. (CA) | 1982-06-29 | — | — | US | disclosed |