Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL28616712 | 0.89 | HRH3 (0.44) | TSHRACHECHRNB2CHRNA5CHRNA7 | |
| Carbamic Acid SCHEMBL28886943 | 0.82 | HPGD (0.31) | — | |
| Hydrogen Peroxide SCHEMBL29110073 | 0.78 | ALDH1A1 (0.33) | HSD17B10L3MBTL1ALDH1A1 | |
| SCHEMBL25239012 | 0.76 | CNR2 (0.36) | PARP1OPRM1CHRNB2CHRNA7CHRNA4 | |
| Succinic Acid SCHEMBL7251989 | 0.74 | HRH3 (0.37) | POLBMAPTOPRM1OPRD1ALDH1A1 | |
| Hypochlorous Acid SCHEMBL18191767 | 0.74 | HPGD (0.35) | — | |
| Hno SCHEMBL17556394 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL15018678 | 0.73 | KDM4E (0.30) | HSD17B10ALDH1A1 | |
| Calcium SCHEMBL31257197 | 0.73 | KDM4E (0.30) | HSD17B10ALDH1A1 | |
| Rubidium SCHEMBL31257199 | 0.73 | KDM4E (0.30) | HSD17B10ALDH1A1 |
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-117979962-A | Novel synergistic combinations for treating cancer and methods of use thereof | 波尔多大学 | 2024-05-03 | — | — | CN | disclosed |
| CN-113543783-A | Kinase inhibitor compounds and compositions and methods of use | 西奈山伊坎医学院 | 2021-10-22 | — | — | CN | disclosed |
| CN-113508111-A | Kinase inhibitor compounds and compositions and methods of use | 西奈山伊坎医学院 | 2021-10-15 | — | — | CN | disclosed |
| CN-112135613-A | Kinase inhibitor compounds and compositions and methods of use | 西奈山伊坎医学院 | 2020-12-25 | — | — | CN | disclosed |
| CN-111936490-A | Kinase inhibitor compounds and compositions and methods of use | 西奈山伊坎医学院 | 2020-11-13 | — | — | CN | disclosed |