Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL528621 | 1.00 | ALDH1A1 (0.48) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL529268 | 0.93 | ALDH1A1 (0.46) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL529269 | 0.93 | ALDH1A1 (0.46) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL531305 | 0.89 | GPR139 (0.48) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL531306 | 0.89 | GPR139 (0.48) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL526554 | 0.88 | ALDH1A1 (0.52) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL527661 | 0.88 | KMT2A (0.45) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL527662 | 0.88 | KMT2A (0.45) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL527863 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KMT2AKDM4EHTTMEN1 | |
| SCHEMBL527864 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KMT2AKDM4EHTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2598493-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012014114-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-02-02 | — | — | WO | disclosed |