Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.36 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21443604 | 0.89 | MEN1 (0.36) | KMT2ALMNAMEN1THRBBLM | |
| SCHEMBL31459294 | 0.81 | ALDH1A1 (0.36) | ALDH1A1OPRM1 | |
| SCHEMBL10526403 | 0.80 | OPRM1 (0.39) | KMT2AMEN1ALDH1A1SMN1; SMN2OPRM1 | |
| SCHEMBL9878437 | 0.76 | ADORA2A (0.34) | ALDH1A1 | |
| SCHEMBL16767385 | 0.76 | SRC (0.37) | KMT2AMEN1ALDH1A1TSHRHPGD | |
| SCHEMBL16767321 | 0.76 | ERN1 (0.43) | TDP1ALDH1A1OPRM1ERN1 | |
| SCHEMBL2050361 | 0.72 | CA12 (0.38) | KMT2ALMNAMEN1BLMTDP1 | |
| SCHEMBL1769351 | 0.72 | HDAC4 (0.41) | LMNAALDH1A1SMN1; SMN2OPRM1NPC1 | |
| SCHEMBL30929543 | 0.72 | HDAC4 (0.41) | LMNAALDH1A1SMN1; SMN2OPRM1NPC1 | |
| SCHEMBL6898 | 0.71 | HTR2A (0.35) | KMT2AMEN1ALDH1A1SMN1; SMN2OPRM1 |
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-2016106106-A2 | FUSED HETEROARYL DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-06-30 | — | — | WO | disclosed |