Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.46 |
| ▸ | CCR2 | P41597 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CTSE | P14091 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18716477 | 0.85 | SMN1; SMN2 (0.48) | SMN1; SMN2CCR1CCR2ALDH1A1RAB9A | |
| SCHEMBL5964510 | 0.78 | MMP1 (0.39) | MMP1MMP3MMP9CCR1CCR2 | |
| SCHEMBL5964515 | 0.78 | MMP1 (0.39) | MMP1MMP3MMP9CCR1CCR2 | |
| SCHEMBL9375637 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2CCR1ALDH1A1RAB9AMAPT | |
| SCHEMBL4186033 | 0.72 | SMN1; SMN2 (0.55) | SMN1; SMN2CCR1CCR2ALDH1A1RAB9A | |
| SCHEMBL13879557 | 0.72 | MMP1 (0.51) | MMP1MMP3MMP9ALDH1A1EPHX2 | |
| SCHEMBL21944956 | 0.71 | SMN1; SMN2 (0.60) | SMN1; SMN2ALDH1A1RAB9AMAPTKDM4E | |
| SCHEMBL23192194 | 0.68 | ALDH1A1 (0.40) | ALDH1A1KDM4ETSHR | |
| SCHEMBL17304246 | 0.68 | ALDH1A1 (0.40) | ALDH1A1KDM4ETSHR | |
| SCHEMBL20306410 | 0.68 | ALDH1A1 (0.40) | ALDH1A1KDM4ETSHR |
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-5294737-A | Hydrolysis, cyclization, condensation | THE RESEARCH FOUNDATION STATE UNIVERSITY OF NEW YORK (US) | 1994-03-15 | — | — | US | disclosed |