Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.43 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8999545 | 0.83 | GPR3 (0.54) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL29202280 | 0.80 | GPR3 (0.50) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL6038134 | 0.76 | POLB (0.51) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL17710463 | 0.74 | GPR3 (0.52) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL88303 | 0.73 | GPR3 (0.57) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL27838676 | 0.72 | GPR3 (0.42) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL9398144 | 0.72 | KMT2A (0.42) | GPR3POLBKMT2ASLC22A2SLC22A3 | |
| SCHEMBL24628375 | 0.72 | POLB (0.47) | POLBKMT2AHDAC3HDAC4HDAC7 | |
| SCHEMBL7043488 | 0.71 | HDAC3 (0.57) | GPR3POLBKMT2AHDAC3HDAC4 | |
| Acetone SCHEMBL8469766 | 0.71 | POLB (0.55) | GPR3POLBKMT2AHDAC3HDAC4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1349990-A | Heterocyclic compound, its preparation and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-05-22 | — | — | CN | disclosed |
| CN-1077107-C | Heterocyclic compounds, their preparation and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-01-02 | — | — | CN | disclosed |
| CN-1223653-A | Heterocyclic compounds, their preparation and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-07-21 | — | — | CN | disclosed |