Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20330054 | 0.87 | ABCB1 (0.49) | ABCB1MMP1ALDH1A1LMNAKDM4E | |
| SCHEMBL14209809 | 0.86 | TSHR (0.50) | ALDH1A1LMNACYP2C19SLC1A3SLC1A2 | |
| SCHEMBL21367030 | 0.85 | USP2 (0.45) | CYP2C19SLC1A3SLC1A2SLC1A1CYP2C9 | |
| SCHEMBL21367031 | 0.85 | USP2 (0.45) | CYP2C19SLC1A3SLC1A2SLC1A1CYP2C9 | |
| SCHEMBL28054152 | 0.82 | MMP1 (0.46) | ABCB1MMP1ALDH1A1LMNAKDM4E | |
| SCHEMBL27884801 | 0.81 | ABCB1 (0.45) | ABCB1MMP1ALDH1A1LMNAKDM4E | |
| SCHEMBL8855042 | 0.81 | MMP1 (0.42) | ABCB1MMP1ALDH1A1LMNAKDM4E | |
| SCHEMBL1776277 | 0.80 | SMN1; SMN2 (0.43) | CYP2C19SLC1A3SLC1A2SLC1A1CYP2C9 | |
| SCHEMBL16591208 | 0.79 | MAPT (0.43) | SLC1A1MAPT | |
| SCHEMBL14232641 | 0.78 | TSHR (0.45) | ALDH1A1LMNACYP2C19MEN1CYP1A2 |
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-2019177873-A1 | ARGINASE INHIBITORS AND METHODS OF USE | MERCK SHARP & DOHME CORP. (US) | 2019-09-19 | — | — | WO | disclosed |