Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | FNTA | P49354 | 1/20 | 0.32 |
| ▸ | FNTB | P49356 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL7442872 | 0.77 | BACE1 (0.39) | BACE1KMT2AL3MBTL1KDM4ECTSS | |
| SCHEMBL8628579 | 0.74 | NPSR1 (0.46) | BACE1L3MBTL1CA14FNTAFNTB | |
| SCHEMBL7229620 | 0.71 | SMPD2 (0.41) | BACE1KMT2AKDM4ECTSSCTSK | |
| SCHEMBL1432658 | 0.71 | SMPD2 (0.41) | BACE1KMT2AKDM4ECTSSCTSK | |
| SCHEMBL1326634 | 0.71 | SMPD2 (0.41) | BACE1KMT2AKDM4ECTSSCTSK | |
| SCHEMBL8625900 | 0.71 | L3MBTL1 (0.45) | KMT2AL3MBTL1CA14ALDH1A1TSHR | |
| SCHEMBL4832420 | 0.70 | KEAP1 (0.44) | BACE1KMT2AL3MBTL1KDM4EMMP9 | |
| SCHEMBL27597531 | 0.69 | MEN1 (0.40) | BACE1KMT2AKDM4ECTSSCTSK | |
| SCHEMBL6139113 | 0.69 | MEN1 (0.40) | BACE1KMT2AKDM4ECTSSCTSK | |
| SCHEMBL27609081 | 0.69 | KMT2A (0.38) | KMT2AKDM4EALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5753714-A | ANTIPROTOZOA AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1998-05-19 | — | — | US | disclosed |