Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 9/20 | 0.41 |
| ▸ | ITGAV | P06756 | 4/20 | 0.41 |
| ▸ | ELANE | P08246 | 4/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.40 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.40 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | KRAS | P01116 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 2/20 | 0.38 |
| ▸ | MC5R | P33032 | 2/20 | 0.38 |
| ▸ | MC3R | P41968 | 2/20 | 0.38 |
| ▸ | MC1R | Q01726 | 2/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12019244 | 0.88 | CACNA1B (0.42) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL19362491 | 0.86 | FOLH1 (0.47) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL18022821 | 0.84 | ITGB3 (0.40) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL19362494 | 0.82 | ITGB3 (0.50) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL12019300 | 0.82 | ITGB3 (0.46) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL18022819 | 0.82 | CACNA1B (0.40) | CACNA1BITGB3ELANEITGA2BCTSG | |
| SCHEMBL17178028 | 0.80 | ITGB3 (0.46) | CACNA1BITGB3ITGAVELANEITGA2B | |
| SCHEMBL29393726 | 0.78 | ITGB3 (0.59) | CACNA1BITGB3ITGAVITGA2BITGB5 | |
| SCHEMBL16301538 | 0.77 | ITGB3 (0.55) | CACNA1BITGB3ITGAVITGA2BITGB1 | |
| SCHEMBL21467216 | 0.76 | NNMT (0.36) | CACNA1BITGB3ELANEITGA2BCTSG |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9079867-B2 | Polyazamacrocyclic compound, and a production method and a biomedical use therefor | KYUNGPOOK NATIONAL UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) | 2015-07-14 | — | — | US | disclosed |