Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1044055 | 1.00 | GPR3 (0.41) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL16632987 | 0.84 | GPR3 (0.41) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL5034116 | 0.78 | GPR3 (0.34) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL9020786 | 0.78 | ALDH1A1 (0.35) | GPR3POLBACHEKMT2AMEN1 | |
| SCHEMBL1478687 | 0.78 | GPR3 (0.44) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL9020869 | 0.75 | PDCD1 (0.39) | HTR2A | |
| SCHEMBL18343745 | 0.75 | GPR3 (0.32) | GPR3POLBKMT2AMEN1CYP1A2 | |
| SCHEMBL27462668 | 0.74 | GPR3 (0.41) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL6903531 | 0.69 | GPR3 (0.46) | GPR3HTR2AHDAC3HDAC4HDAC7 | |
| SCHEMBL221399 | 0.69 | GPR3 (0.46) | GPR3HTR2AHDAC3HDAC4HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115536633-A | Compound and organic electroluminescent element comprising same | 索路思高新材料有限公司 | 2022-12-30 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |