Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 10/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | PRKACG | P22612 | 1/20 | 0.39 |
| ▸ | PRKACB | P22694 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19720084 | 0.86 | ADORA1 (0.42) | ADORA1MEN1KMT2APRKACAPRKACG | |
| SCHEMBL8914694 | 0.83 | ADORA1 (0.54) | ADORA1MEN1KMT2AGAAGFER | |
| SCHEMBL15613582 | 0.83 | ADORA1 (0.54) | ADORA1MEN1KMT2APRKACAPRKACG | |
| SCHEMBL2645516 | 0.82 | ADORA1 (0.58) | ADORA1MEN1KMT2AGAAADORA2A | |
| SCHEMBL8124145 | 0.80 | ADORA1 (0.65) | ADORA1MEN1KMT2AADORA2ADYRK1A | |
| SCHEMBL20334862 | 0.80 | ADORA1 (0.45) | ADORA1MEN1KMT2APRKACAPRKACG | |
| SCHEMBL18253230 | 0.79 | IKBKB (0.47) | ADORA1MEN1KMT2APRKACAPRKACG | |
| SCHEMBL10925763 | 0.79 | MYC (0.48) | ADORA1MEN1KMT2ANPC1ALDH1A1 | |
| SCHEMBL12123262 | 0.79 | MEN1 (0.40) | ADORA1MEN1KMT2APRKACAPRKACG | |
| SCHEMBL15472736 | 0.78 | ERBB2 (0.58) | ADORA1MEN1KMT2AADORA2ACDK5 |
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-8518970-B2 | Compounds and methods of use | ABBVIE INC. (US) | 2013-08-27 | — | — | US | disclosed |