Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | AGER | Q15109 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31047027 | 0.83 | METAP1 (0.64) | METAP1KDM4EALDH1A1CYP3A4MAPT | |
| SCHEMBL222446 | 0.80 | RXFP1 (0.55) | KDM4ECA2CA12CA9RXFP1 | |
| SCHEMBL29702265 | 0.80 | RXFP1 (0.55) | KDM4ECA2CA12CA9RXFP1 | |
| SCHEMBL3717883 | 0.78 | KDM4C (0.50) | METAP1KDM4ETSHRRXFP1KMT2A | |
| SCHEMBL4669212 | 0.78 | DHODH (0.51) | METAP1KDM4EALDH1A1CYP3A4MAPT | |
| SCHEMBL13211408 | 0.78 | METAP1 (0.64) | METAP1RXFP1KMT2AMEN1BRD9 | |
| SCHEMBL30937705 | 0.78 | METAP1 (0.64) | METAP1RXFP1KMT2AMEN1BRD9 | |
| SCHEMBL4345991 | 0.77 | METAP1 (0.62) | METAP1KDM4EALDH1A1L3MBTL1RXFP1 | |
| SCHEMBL2880191 | 0.77 | LMNA (0.54) | METAP1ALDH1A1CA12ALOX15RXFP1 | |
| SCHEMBL2829176 | 0.76 | POLB (0.56) | ALDH1A1CYP3A4L3MBTL1RXFP1ATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-2220042-A1 | NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES | 4SC AG (DE) | 2010-08-25 | — | — | EP | disclosed |
| WO-2009063054-A1 | NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES | 4SC AG (DE) | 2009-05-22 | — | — | WO | disclosed |