Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL11491026 | 0.94 | TSHR (0.44) | TSHRCYP1A2CYP2C9CHRNB4CHRNA3 | |
| SCHEMBL28133025 | 0.83 | CNR1 (0.38) | POLBCNR1DPP4RAB9ADPP8 | |
| SCHEMBL28133009 | 0.83 | CNR1 (0.38) | POLBCNR1DPP4RAB9ADPP8 | |
| SCHEMBL28133007 | 0.83 | CNR1 (0.38) | POLBCNR1DPP4RAB9ADPP8 | |
| SCHEMBL14457242 | 0.82 | HSD17B10 (0.50) | USP2 | |
| SCHEMBL9977242 | 0.82 | HSD17B10 (0.50) | USP2 | |
| SCHEMBL16590799 | 0.82 | TSHR (0.40) | TSHRCYP1A2CYP2C9CHRNB4CHRNA3 | |
| SCHEMBL925960 | 0.82 | HSD17B10 (0.50) | USP2 | |
| SCHEMBL11482913 | 0.82 | THRB (0.41) | TSHRPOLBDPP4DPP8DPP9 | |
| SCHEMBL2428695 | 0.82 | DPP4 (0.39) | POLBCNR1DPP4RAB9AL3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114591212-A | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2022-06-07 | — | — | CN | disclosed |
| JP-2002145845-A | METHOD FOR MANUFACTURING Y-AMINOKETONE DERIVATIVE | TOKUYAMA CORP | 2002-05-22 | — | — | JP | disclosed |
| US-4234484-A | FROM ALKOXYLATED CYCLIC AMIDES USING AS A CATALYST A QUATERNARY AMMONIUM OR ALKALI METAL SALT OF TETRAFLUOROBORIC OR HEXAFLUOROPHOSPHORIC ACID | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-11-18 | — | — | US | disclosed |
| US-4149941-A | ELECTROLYTIC ALKOXYLATION | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-04-17 | — | — | US | disclosed |
| US-4118500-A | Fungicidal alkoxy mono- and dialkoxy N-substituted cyclic amines | HOECHST AKTIENGESELLSCHAFT (DE) | 1978-10-03 | — | — | US | disclosed |