Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.60 |
| ▸ | ALPL | P05186 | 1/20 | 0.60 |
| ▸ | RPA1 | P27694 | 1/20 | 0.60 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 10/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 10/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 10/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 10/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 10/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 10/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27706536 | 0.86 | TP53 (0.54) | NR1H4MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL28046606 | 0.85 | TP53 (0.57) | NR1H4ACR | |
| SCHEMBL22191820 | 0.81 | NR1H4 (0.42) | CA12ALPLRPA1NR1H4MAPT | |
| SCHEMBL14814428 | 0.80 | CA12 (0.54) | CA12ALPLRPA1NR1H4MAPT | |
| SCHEMBL2522578 | 0.79 | CA12 (0.53) | CA12ALPLRPA1NR1H4MAPT | |
| SCHEMBL14985512 | 0.77 | CA12 (0.50) | CA12ALPLRPA1NR1H4MAPT | |
| SCHEMBL14844870 | 0.76 | CA12 (0.50) | CA12ALPLRPA1NR1H4MAPT | |
| SCHEMBL22191641 | 0.76 | CYP2D6 (0.67) | NR1H4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3447352 | 0.76 | ALPL (1.00) | CA12ALPLRPA1HDAC3HDAC4 | |
| SCHEMBL14985499 | 0.76 | HCAR2 (0.51) | CA12ALPLRPA1NR1H4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102947303-A | Bicyclic pyrimidinyl pyrazoles | BAYER CROPSCIENCE AG | 2013-02-27 | — | — | CN | disclosed |