Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HPSE | Q9Y251 | 4/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL27739741 | 0.88 | POLB (0.35) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL28310795 | 0.73 | GAA (0.74) | ALDH1A1GAAMEN1KMT2ANPC1 | |
| SCHEMBL3856893 | 0.70 | TDP1 (0.43) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL2731562 | 0.70 | PKM (0.56) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL27739678 | 0.69 | ALDH1A1 (0.36) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL28039058 | 0.69 | MTNR1A (0.35) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL5728015 | 0.69 | KDM4E (0.45) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL29306046 | 0.68 | ECE2 (0.58) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL7972175 | 0.68 | GAA (0.59) | ALDH1A1GAAMEN1KMT2APOLB | |
| SCHEMBL15887331 | 0.67 | GAA (0.56) | ALDH1A1GAAMEN1KMT2APOLB |
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-1751025-B | Diamine derivatives | DAIICHI SEIYAKU CO | 2010-05-12 | — | — | CN | disclosed |
| CN-101263110-A | Optically active diamine derivative and process for producing the same | DAIICHI SANKYO CO LTD (JP) | 2008-09-10 | — | — | CN | disclosed |