Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9249020 | 0.79 | MAOB (0.45) | HSD11B1ALDH1A1 | |
| SCHEMBL9249015 | 0.79 | MAOB (0.45) | HSD11B1ALDH1A1 | |
| SCHEMBL9252834 | 0.79 | MAOB (0.45) | HSD11B1ALDH1A1 | |
| SCHEMBL13953489 | 0.78 | SLC18A3 (0.41) | KDM1A | |
| SCHEMBL23705383 | 0.77 | CHRNA1 (0.46) | HSD11B1KDM1ARCOR1CTSDBACE1 | |
| SCHEMBL25706676 | 0.77 | CHRNA1 (0.46) | HSD11B1KDM1ARCOR1CTSDBACE1 | |
| SCHEMBL25720453 | 0.76 | MEN1 (0.41) | TAAR1HSD17B10TSHRHSD11B1KDM1A | |
| SCHEMBL1608039 | 0.75 | KDM1A (0.40) | TAAR1HSD11B1KDM1ARCOR1CYP2A6 | |
| SCHEMBL10226674 | 0.75 | KDM1A (0.40) | TAAR1HSD11B1KDM1ARCOR1CYP2A6 | |
| SCHEMBL1539148 | 0.75 | KDM1A (0.40) | TAAR1HSD11B1KDM1ARCOR1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018093696-A1 | INDAZOLE DERIVATIVES USEFUL AS INHIBITORS OF DIACYLGLYCERIDE O-ACYLTRANSFERASE 2 | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |