Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 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 | |
|---|---|---|---|---|
| SCHEMBL5846805 | 0.96 | ALDH1A1 (0.47) | ALDH1A1MAPTADRB2ADRB1ADRB3 | |
| SCHEMBL29952577 | 0.80 | UNG (0.46) | ALDH1A1MAPTMIFNPC1RAB9A | |
| SCHEMBL617014 | 0.79 | MAPT (0.52) | ALDH1A1MAPTSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL15149335 | 0.79 | MIF (0.48) | MAPTADRB2ADRB1ADRB3MIF | |
| SCHEMBL8853922 | 0.78 | PPARG (0.44) | ALDH1A1MAPTMIFNPC1RAB9A | |
| SCHEMBL8853850 | 0.78 | CA12 (0.50) | ALDH1A1MAPTSMN1; SMN2EPHX2NR1H4 | |
| SCHEMBL32687527 | 0.78 | RAB9A (0.49) | ALDH1A1MAPTNPC1RAB9ARECQL | |
| SCHEMBL7438712 | 0.78 | ADRB2 (0.40) | MAPTADRB2ADRB1ADRB3EPHX2 | |
| SCHEMBL616504 | 0.78 | CA1 (0.46) | ALDH1A1MAPTRAB9AKDM4ECA12 | |
| SCHEMBL7422422 | 0.78 | NFKB1 (0.39) | MAPTCYP17A1CA1CA2NFKB1 |
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-2015087857-A1 | ARYL AMIDINE COMPOUND AND BACTERICIDAL AGENT | 日本曹達株式会社 | 2015-06-18 | — | — | WO | disclosed |