Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 9/20 | 0.61 |
| ▸ | HSD17B2 | P37059 | 9/20 | 0.61 |
| ▸ | NQO2 | P16083 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 3/20 | 0.45 |
| ▸ | SNCA | P37840 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11522443 | 0.96 | HSD17B1 (0.57) | HSD17B1HSD17B2NQO2MEN1POLB | |
| SCHEMBL14506144 | 0.96 | HSD17B1 (0.57) | HSD17B1HSD17B2NQO2MEN1POLB | |
| SCHEMBL13335785 | 0.89 | HSD17B1 (0.70) | HSD17B1HSD17B2ESR1ESR2CYP3A4 | |
| SCHEMBL12245629 | 0.89 | HSD17B1 (0.50) | HSD17B1HSD17B2NQO2CYP3A4CYP2C19 | |
| SCHEMBL13304737 | 0.89 | APP (0.55) | HSD17B1HSD17B2NQO2MEN1KMT2A | |
| SCHEMBL31388296 | 0.88 | GSTP1 (0.50) | HSD17B1HSD17B2RAB9AESR1ESR2 | |
| SCHEMBL4404623 | 0.88 | GSTP1 (0.50) | HSD17B1HSD17B2RAB9AESR1ESR2 | |
| SCHEMBL14077250 | 0.87 | RELA (0.52) | HSD17B1HSD17B2NQO2MEN1POLB | |
| SCHEMBL14505876 | 0.87 | HSD17B1 (0.49) | HSD17B1HSD17B2NQO2CYP3A4CYP2C19 | |
| SCHEMBL9976851 | 0.86 | GSTP1 (0.48) | HSD17B1HSD17B2RAB9AESR1ESR2 |
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-20080100213-A1 | LUMINESCENT DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2008-05-01 | — | — | US | disclosed |
| US-20080100213-A1 | LUMINESCENT DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2008-05-01 | — | — | US | disclosed |