Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL60004 | 0.77 | RAD52 (0.55) | TDP1CYP1A2MAPK1CYP2C19MEN1 | |
| SCHEMBL5310777 | 0.77 | KDM4E (0.45) | TDP1TSHRCYP1A2MAPK1CYP2C19 | |
| SCHEMBL29677121 | 0.77 | KDM4E (0.45) | TDP1TSHRCYP1A2MAPK1CYP2C19 | |
| Phenyl Ethanol SCHEMBL1593439 | 0.77 | KDM1A (0.43) | MEN1KMT2AKDM1ARAD52 | |
| Hydrochloric Acid SCHEMBL11149959 | 0.76 | RAD52 (0.53) | SIGMAR1TDP1CYP1A2MAPK1CYP2C19 | |
| SCHEMBL7398453 | 0.73 | SIGMAR1 (0.44) | SIGMAR1HTR2AHTR2CHTR2BTSHR | |
| Hydrochloric Acid SCHEMBL11788510 | 0.72 | KDM1A (0.47) | SIGMAR1MEN1BLMPMP22KMT2A | |
| Phenylethyl Alcohol SCHEMBL27779032 | 0.70 | TDP1 (0.76) | TDP1HTR2ATSHRMAPK1 | |
| SCHEMBL8522929 | 0.70 | KDM4E (0.42) | SIGMAR1TDP1HTR2AHTR2CHTR2B | |
| SCHEMBL9433786 | 0.70 | KDM1A (0.49) | TP53MAPK1MEN1KMT2AKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002302464-A | OPTICALLY ACTIVE HALOHYDRIN DERIVATIVE AND USE THEREOF | KISSEI PHARMACEUT CO LTD | 2002-10-18 | — | — | JP | disclosed |