Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.76 |
| ▸ | BCR | P11274 | 4/20 | 0.76 |
| ▸ | HPGD | P15428 | 6/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.51 |
| ▸ | TACR3 | P29371 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10198116 | 0.97 | ABL1 (0.76) | ABL1BCRHPGDMAPK1ALDH1A1 | |
| SCHEMBL27556543 | 0.87 | ABL1 (0.71) | ABL1BCRHPGDMAPK1ALDH1A1 | |
| SCHEMBL911426 | 0.79 | ABL1 (0.64) | ABL1BCRALDH1A1TACR3 | |
| SCHEMBL4052776 | 0.78 | ABL1 (0.50) | ABL1BCRHPGDALDH1A1GAA | |
| SCHEMBL764268 | 0.77 | ABL1 (0.54) | ABL1BCRHPGDALDH1A1GAA | |
| SCHEMBL764282 | 0.77 | HDAC3 (0.52) | ABL1BCRHPGDALDH1A1GAA | |
| SCHEMBL10721733 | 0.77 | HPGD (0.95) | HPGDMAPK1ALDH1A1MEN1TSHR | |
| SCHEMBL3901121 | 0.76 | HDAC3 (0.62) | ABL1BCRHPGDALDH1A1GAA | |
| SCHEMBL764280 | 0.76 | ABL1 (0.53) | ABL1BCRHPGDALDH1A1GAA | |
| SCHEMBL6614562 | 0.76 | HPGD (1.00) | HPGDMAPK1ALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2078015-B1 | MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1 AND/OR NF-KAPPAB ACTIVITY AND USE THEREOF | BRISTOL MYERS SQUIBB CO (US) | 2012-03-21 | — | — | EP | disclosed |