Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.32 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3841520 | 0.81 | ALDH1A1 (0.44) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL13558619 | 0.64 | LMNA (0.30) | ALDH1A1LMNA | |
| SCHEMBL2352202 | 0.63 | ALDH1A1 (0.42) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL3192929 | 0.63 | CES2 (0.59) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL29923032 | 0.62 | HPGD (0.42) | ALDH1A1LMNASMN1; SMN2KMT2AL3MBTL1 | |
| SCHEMBL27417891 | 0.61 | SMN1; SMN2 (0.37) | ALDH1A1SMN1; SMN2KMT2AMEN1HPGD | |
| SCHEMBL3545870 | 0.60 | ALDH1A1 (0.66) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL12261048 | 0.60 | CES2 (0.68) | ALDH1A1LMNAKMT2AMEN1L3MBTL1 | |
| SCHEMBL14471069 | 0.60 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL22575081 | 0.60 | ALDH1A1 (0.43) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 |
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-2012013310-A1 | POLYMERS CONTAINING SUBSTITUTED BENZODITHIOPHENE UNITS, BLENDS CONTAINING SAID POLYMERS, AND DEVICES CONTAINING SAID POLYMERS OR BLENDS | MERCK PATENT GMBH (DE) | 2012-02-02 | — | — | WO | disclosed |