Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | HSD17B3 | P37058 | 7/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.42 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.42 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.42 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.42 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.42 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.42 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.42 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.42 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.42 |
| ▸ | PSMA5 | P28066 | 1/20 | 0.42 |
| ▸ | PSMB4 | P28070 | 1/20 | 0.42 |
| ▸ | PSMB6 | P28072 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8043717 | 1.00 | ESR1 (0.55) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL74674 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL9472405 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL2862178 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL895364 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL4184704 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL5029048 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL339165 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL10752311 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL2150972 | 0.89 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 |
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-6048387-A | SPECIFIED DIAZARHODAMINE LACTONE DERIVATIVE AS AN ELECTRON-DONATING COLOR-DEVELOPING ORGANIC COMPOUND | THE PILOT INK CO., LTD. (JP) | 2000-04-11 | — | — | US | disclosed |