Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 7/20 | 0.49 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.43 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.43 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.43 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.43 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.43 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.43 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.43 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.43 |
| ▸ | PSMA5 | P28066 | 1/20 | 0.43 |
| ▸ | PSMB4 | P28070 | 1/20 | 0.43 |
| ▸ | PSMB6 | P28072 | 1/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.43 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.43 |
| ▸ | PSMB3 | P49720 | 1/20 | 0.43 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.43 |
| ▸ | PSMA6 | P60900 | 1/20 | 0.43 |
| ▸ | PSMA8 | Q8TAA3 | 1/20 | 0.43 |
| ▸ | PSMB7 | Q99436 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8035013 | 0.80 | HSD17B3 (0.49) | HSD17B3PSMB11PSMA7PSMB1PSMA1 | |
| SCHEMBL19458774 | 0.78 | HSD17B3 (0.47) | HSD17B3MIFESR1ESR2HTT | |
| SCHEMBL4951952 | 0.76 | HSD17B3 (0.48) | HSD17B3MIFESR1ADRA2AADORA3 | |
| SCHEMBL29130050 | 0.73 | ESR1 (0.44) | HSD17B3MIFESR1ESR2NR5A1 | |
| Bisphenol A SCHEMBL30662014 | 0.73 | GPR84 (0.55) | HSD17B3ESR1ESR2ALDH1A1CYP3A4 | |
| Bisphenol A SCHEMBL29613004 | 0.73 | GPR84 (0.55) | HSD17B3ESR1ESR2ALDH1A1CYP3A4 | |
| Bisphenol A SCHEMBL15987812 | 0.73 | GPR84 (0.55) | HSD17B3ESR1ESR2ALDH1A1CYP3A4 | |
| Bisphenol A SCHEMBL29407101 | 0.73 | GPR84 (0.55) | HSD17B3ESR1ESR2ALDH1A1CYP3A4 | |
| Bisphenol A SCHEMBL29440820 | 0.73 | GPR84 (0.55) | HSD17B3ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL8045582 | 0.72 | ESR1 (0.54) | HSD17B3PSMB11PSMA7PSMB1PSMA1 |
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 |