Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CBFB | Q13951 | 6/20 | 0.52 |
| ▸ | METAP2 | P50579 | 5/20 | 0.52 |
| ▸ | METAP1 | P53582 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | BTK | Q06187 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9846300 | 0.82 | NPC1 (0.55) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL2723725 | 0.77 | KMT2A (0.57) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL5396521 | 0.76 | KDM4E (0.50) | METAP2METAP1NPC1LMNARAB9A | |
| SCHEMBL28536155 | 0.74 | NPY5R (0.59) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL13611987 | 0.73 | LMNA (0.54) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL9846148 | 0.73 | BTK (0.46) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL5390769 | 0.72 | NPY5R (0.53) | NPC1LMNARAB9AALDH1A1HTT | |
| SCHEMBL15094659 | 0.71 | BTK (0.64) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL20595283 | 0.71 | BTK (0.50) | CBFBMETAP2METAP1NPC1LMNA | |
| SCHEMBL2893940 | 0.71 | METAP2 (0.53) | CBFBMETAP2METAP1NPC1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012052390-A1 | N-2-(2-PYRIDINYL)-4-PYRIMIDINYL-BETA-ALANINE DERIVATIVES AS INHIBITORS OF HISTONE DEMETHYLASE JMJD3 | GLAXO GROUP LIMITED (GB) | 2012-04-26 | — | — | WO | disclosed |