Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | PRF1 | P14222 | 2/20 | 0.52 |
| ▸ | MMP13 | P45452 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24343521 | 0.88 | KDM4E (0.49) | ALDH1A1KDM4ENPSR1L3MBTL1POLB | |
| SCHEMBL2021463 | 0.80 | PRF1 (0.61) | ALDH1A1KDM4EPRF1MMP13CA12 | |
| SCHEMBL24534467 | 0.80 | NPC1 (0.51) | ALDH1A1KDM4EPRF1MMP13HDAC6 | |
| SCHEMBL17921126 | 0.78 | NPC1 (0.41) | ALDH1A1KDM4EPRF1CA12CA1 | |
| SCHEMBL620074 | 0.77 | POLB (0.66) | ALDH1A1KDM4EMMP13CA12CA1 | |
| SCHEMBL17921131 | 0.77 | MAPT (0.39) | ALDH1A1KDM4ECA1CA2L3MBTL1 | |
| SCHEMBL23110055 | 0.77 | ACKR3 (0.62) | ALDH1A1KDM4EMMP13HPGDNPC1 | |
| SCHEMBL764574 | 0.76 | MMP13 (0.81) | ALDH1A1KDM4EMMP13CA12CA1 | |
| SCHEMBL16250219 | 0.75 | NPC1 (0.55) | ALDH1A1KDM4EMMP13L3MBTL1HDAC6 | |
| SCHEMBL16511794 | 0.75 | SLC6A2 (0.45) | MMP13 |
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 |