Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5564148 | 0.85 | KMT2A (0.48) | KMT2ATSHRSIRT1POLBNOTUM | |
| SCHEMBL31306532 | 0.83 | KMT2A (0.69) | KMT2ATSHRHPGDPOLBNOTUM | |
| SCHEMBL15157267 | 0.83 | KMT2A (0.69) | KMT2ATSHRHPGDPOLBNOTUM | |
| SCHEMBL7296326 | 0.81 | KMT2A (0.62) | KMT2ATSHRHPGDNPC1RAB9A | |
| SCHEMBL11995109 | 0.77 | ABCG2 (0.42) | KMT2ATSHRHPGDLMNASMN1; SMN2 | |
| SCHEMBL1970130 | 0.77 | HPGD (0.46) | KMT2ATSHRHPGDNPC1LMNA | |
| SCHEMBL5559760 | 0.76 | TSHR (0.58) | KMT2ATSHRHPGDLMNATP53 | |
| SCHEMBL4823655 | 0.76 | SIRT1 (0.52) | KMT2AHPGDNPC1LMNATP53 | |
| SCHEMBL3806102 | 0.75 | ALDH1A1 (0.40) | KMT2ATSHRHPGDNPC1LMNA | |
| SCHEMBL28171665 | 0.75 | SIRT1 (0.51) | TSHRHPGDLMNASIRT1CYP2D6 |
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-2011138657-A1 | ARYL SUBSTITUTED OLEFINIC COMPOUNDS AS PDE10A INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-11-10 | — | — | WO | disclosed |