Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TYMP | P19971 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8597722 | 0.83 | CYP1A2 (0.47) | TRPM4CYP1A2MCL1ACMSDNQO2 | |
| SCHEMBL10952640 | 0.82 | IDO1 (0.56) | TRPM4CYP1A2NQO2KDM4EESR1 | |
| SCHEMBL29360295 | 0.80 | NSD2 (0.54) | CYP1A2MCL1ACMSDPTPN22KDM4E | |
| SCHEMBL214870 | 0.80 | NSD2 (0.54) | CYP1A2MCL1ACMSDPTPN22KDM4E | |
| SCHEMBL28063135 | 0.80 | MCL1 (0.46) | CYP1A2MCL1ACMSDKDM4EESR2 | |
| SCHEMBL631770 | 0.79 | CYP1A2 (0.62) | TRPM4CYP1A2MCL1ACMSDPTPN22 | |
| SCHEMBL30772437 | 0.79 | CYP1A2 (0.56) | CYP1A2MCL1ACMSDPTPN22DHFR | |
| SCHEMBL29587504 | 0.79 | CYP1A2 (0.62) | TRPM4CYP1A2MCL1ACMSDPTPN22 | |
| SCHEMBL702934 | 0.79 | ALDH1A1 (0.50) | CYP1A2DHFRKDM4EALPLGAA | |
| SCHEMBL29407412 | 0.79 | ALDH1A1 (0.50) | CYP1A2DHFRKDM4EALPLGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5122602-A | Optical indicators; medical diagnosis; quantitative analysis; immunoassay | MILES INC. (US) | 1992-06-16 | — | — | US | disclosed |