Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | AXL | P30530 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | PTGIR | P43119 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27837975 | 0.75 | ALDH1A1 (0.56) | MEN1ALDH1A1GAAHPGDSMN1; SMN2 | |
| SCHEMBL26957589 | 0.73 | NOTUM (0.51) | MEN1ALDH1A1GAAHPGDTSHR | |
| SCHEMBL12412921 | 0.73 | MEN1 (0.51) | MEN1PSIP1AXLMKNK1MKNK2 | |
| SCHEMBL20525128 | 0.73 | ALDH1A1 (0.38) | PTGIRALDH1A1HDAC6GAAHPGD | |
| SCHEMBL13096185 | 0.71 | TRPV1 (0.52) | MEN1PSIP1AXLMKNK1MKNK2 | |
| SCHEMBL27738853 | 0.69 | CYP2A6 (0.39) | PTGIRALDH1A1SMN1; SMN2 | |
| SCHEMBL5633185 | 0.69 | F7 (0.52) | MKNK1MKNK2PTGIRALDH1A1HDAC1 | |
| SCHEMBL2821898 | 0.68 | ATM (0.69) | PTGIRALDH1A1GAATSHR | |
| SCHEMBL23951598 | 0.68 | ATM (0.42) | MEN1PTGIRTSHR | |
| SCHEMBL3929961 | 0.68 | GRM5 (0.49) | ALDH1A1GAAHPGDTSHRGRM5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102137846-A | N-(2-aminophenyl)-4-[N-(pyridine-3-yl)-methoxycarbonyl-aminomethyl]-benzamide (MS-275)polymorph b | BAYER SCHERING PHARMA AG | 2011-07-27 | — | — | CN | disclosed |