Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 4/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.41 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.41 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8944101 | 0.91 | HSD17B2 (0.50) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL13026514 | 0.89 | CA1 (0.46) | ENPP2CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13385303 | 0.88 | CA4 (0.52) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL12887867 | 0.88 | ABL1 (0.46) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL14163837 | 0.88 | ACHE (0.50) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL15497464 | 0.84 | HSD17B2 (0.41) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL8944301 | 0.84 | HSD17B1 (0.51) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL8943967 | 0.84 | HSD17B1 (0.55) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL8820063 | 0.84 | CA4 (0.50) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 | |
| SCHEMBL10065629 | 0.84 | CA4 (0.50) | HSD17B2HSD17B1MTNR1AMTNR1BENPP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014037847-A2 | NEW SPIRO COMPOUNDS AND THEIR USE IN ORGANIC ELECTRONICS APPLICATIONS AND DEVICES | BASF SE (DE) | 2014-03-13 | — | — | WO | disclosed |
| US-20140066656-A1 | SPIRO COMPOUNDS AND THEIR USE IN ORGANIC ELECTRONICS APPLICATIONS AND DEVICES | BASF SE (DE) | 2014-03-06 | — | — | US | disclosed |