Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL27719945 | 0.83 | SMN1; SMN2 (0.34) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 | |
| SCHEMBL595607 | 0.82 | ALDH1A1 (0.34) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 | |
| SCHEMBL6974279 | 0.79 | DHODH (0.34) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 | |
| SCHEMBL1632856 | 0.77 | MAPT (0.35) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 | |
| SCHEMBL595968 | 0.75 | HTT (0.40) | ALDH1A1KDM4ESMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL10593979 | 0.75 | MAPT (0.40) | ALDH1A1KDM4EMAPTSMN1; SMN2TDP1 | |
| SCHEMBL15956317 | 0.74 | ALDH1A1 (0.39) | ALDH1A1TDP1HDAC3HDAC4HDAC1 | |
| SCHEMBL596880 | 0.72 | ALDH1A1 (0.35) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 | |
| SCHEMBL27858862 | 0.70 | LOXL2 (0.36) | MAPT | |
| SCHEMBL596873 | 0.70 | MCL1 (0.36) | ALDH1A1KDM4EMAPTPKMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101163678-B | Pyridylmethylsulfone derivative | DAIICHI SANKYO CO LTD | 2012-01-04 | — | — | CN | disclosed |
| CN-101163678-A | Pyridylmethylsulfone derivative | DAIICHI SANKYO CO LTD (JP) | 2008-04-16 | — | — | CN | disclosed |