Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL28376025 | 0.63 | ALDH1A1 (0.60) | NISCHALDH1A1RAB9ACYP1A2CYP3A4 | |
| SCHEMBL18923423 | 0.62 | CYP2A6 (0.40) | ALOX5ALDH1A1HTR1DHTR2CHTR2B | |
| SCHEMBL16711400 | 0.61 | IDO1 (0.57) | ALDH1A1ADORA3GAAALOX15HTR2C | |
| SCHEMBL12661831 | 0.61 | IDO1 (0.57) | ALDH1A1ADORA3GAAALOX15HTR2C | |
| SCHEMBL444478 | 0.60 | ALDH1A1 (0.53) | ALDH1A1GAAALOX15RAB9ACYP1A2 | |
| SCHEMBL22889194 | 0.59 | KMT2A (0.47) | ALDH1A1ADORA3GAARAB9ACYP1A2 | |
| Hydrochloric Acid SCHEMBL7107009 | 0.58 | ALDH1A1 (0.50) | ALDH1A1GAAALOX15HTR2CRAB9A | |
| SCHEMBL11328166 | 0.58 | ALDH1A1 (0.42) | ALOX5ALDH1A1GAACYP2A6CYP2B6 | |
| SCHEMBL24385123 | 0.57 | HTR1D (0.32) | ALOX5ALDH1A1HTR1DHTR2CHTR2B | |
| Biphenyl SCHEMBL1072001 | 0.57 | ALDH1A1 (0.69) | ALDH1A1RAB9ACYP1A2CYP3A4TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10844053-B2 | Pyrazol-3-ones that activate pro-apoptotic BAX | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2020-11-24 | — | — | US | disclosed |
| EP-1437388-B1 | Coloring composition and inkjet recording method | FUJIFILM CORP (JP) | 2013-06-19 | — | — | EP | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-10844053-B2 | Pyrazol-3-ones that activate pro-apoptotic BAX | BAX, BAD, CASP3 | ALOX5 3148/4885NISCH 4169/4885ALDH1A1 3612/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.