Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30956083 | 0.75 | MAOB (0.80) | KDM4CMAOBMAOAKDM4ECA2 | |
| SCHEMBL30956076 | 0.75 | MAOB (0.60) | KDM4CMAOBMAOAKDM4ECA2 | |
| SCHEMBL19198153 | 0.75 | ALDH1A1 (0.64) | KDM4EHTR2CRAB9ALTA4HGSK3B | |
| SCHEMBL27429826 | 0.75 | CYP11B1 (0.55) | KDM4CMAOBCA2PSMB5PSMB8 | |
| SCHEMBL15825490 | 0.73 | KDM4C (1.00) | KDM4CKDM4E | |
| SCHEMBL30956090 | 0.72 | MAOB (0.59) | MAOBMAOAKDM4ECA2PSMB5 | |
| SCHEMBL30167103 | 0.72 | MAOB (0.79) | KDM4CMAOBMAOACA2CA12 | |
| SCHEMBL28902190 | 0.72 | MAOB (0.79) | KDM4CMAOBMAOACA2CA12 | |
| SCHEMBL9634215 | 0.71 | CA2 (0.60) | KDM4CMAOBMAOACA2PSMB5 | |
| SCHEMBL19198136 | 0.71 | KMT2A (0.54) | KDM4EHTR2CRAB9ALTA4HGSK3B |
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-9725441-B2 | Histone demethylase inhibitors | CELGENE QUANTICEL RESEARCH, INC. (US) | 2017-08-08 | — | — | US | disclosed |