Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.37 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.37 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.37 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.37 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.37 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12964337 | 0.81 | HTR2A (0.41) | PTAFRHTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL5661115 | 0.80 | HTR2A (0.36) | PTAFRHTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL12704114 | 0.79 | ACHE (0.59) | PTAFRPTGS2KDM4EALDH1A1POLB | |
| SCHEMBL8288099 | 0.79 | HTR2A (0.49) | PTAFRCYP19A1HTR2AHTR2CHTR2B | |
| SCHEMBL191996 | 0.77 | ACHE (0.59) | PTAFRCYP19A1HTR2AHTR2CHTR2B | |
| SCHEMBL2570589 | 0.76 | MAPT (0.48) | CYP19A1HTR2AHTR2CKDM4EALDH1A1 | |
| SCHEMBL7938441 | 0.76 | KDM4E (0.46) | CYP19A1HTR2AHTR2CKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL4381078 | 0.75 | ACHE (0.56) | PTAFRCYP19A1HTR2AHTR2CHTR2B | |
| Ammonia Solution, Strong SCHEMBL4946565 | 0.75 | ACHE (0.56) | PTAFRCYP19A1HTR2AHTR2CHTR2B | |
| SCHEMBL27836626 | 0.71 | ALDH1A1 (0.46) | PTAFRHTR2AKDM4EALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2143714-A1 | TETRAHYDROISOQUINOLINE COMPOUND | Kowa Company, Ltd. (JP) | 2010-01-13 | — | — | EP | disclosed |