Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MEP1B | Q16820 | 3/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MEP1A | Q16819 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27200631 | 0.90 | MEP1B (0.60) | USP2TSHRMEP1BFFAR1KDM4E | |
| SCHEMBL28182017 | 0.87 | MEP1B (0.52) | USP2TSHRMEP1BFFAR1KDM4E | |
| SCHEMBL25489028 | 0.84 | LTA4H (0.46) | USP2TSHRMEP1BKDM4EACHE | |
| SCHEMBL9172532 | 0.81 | MEP1B (0.58) | USP2TSHRMEP1BFFAR1ACHE | |
| SCHEMBL9540871 | 0.79 | ACHE (0.56) | USP2TSHRMEP1BFFAR1ACHE | |
| SCHEMBL21665226 | 0.79 | HDAC8 (0.47) | TSHRMEP1BFFAR1ALDH1A1HTT | |
| SCHEMBL18646559 | 0.79 | TSHR (0.62) | USP2TSHRMEP1BFFAR1KDM4E | |
| SCHEMBL23857640 | 0.79 | MEP1B (0.58) | MEP1BKDM4EF2RL1ACHEALDH1A1 | |
| SCHEMBL17230510 | 0.79 | TSHR (0.49) | TSHR | |
| SCHEMBL25488930 | 0.78 | NR1D1 (0.47) | USP2TSHRMEP1BKDM4EACHE |
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-115996927-A | Pyrimido [5,4-d ] pyrimidine derivatives and combinations with adenosine receptor antagonists as ENT inhibitors for the treatment of cancer | ITEOS比利时公司 | 2023-04-21 | — | — | CN | disclosed |