Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 2/20 | 0.60 |
| ▸ | PSMB8 | P28062 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 3/20 | 0.53 |
| ▸ | MMP2 | P08253 | 2/20 | 0.53 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
| ▸ | MMP12 | P39900 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3826791 | 0.89 | PSMB5 (0.59) | PSMB5PSMB8SMN1; SMN2HTTMAPT | |
| SCHEMBL5220368 | 0.86 | CA12 (0.58) | PSMB5PSMB8SMN1; SMN2HTTMAPT | |
| SCHEMBL10076138 | 0.82 | MMP2 (0.54) | PSMB5PSMB8SMN1; SMN2HTTMAPT | |
| SCHEMBL4899342 | 0.81 | TDP1 (0.63) | MAPTALDH1A1CA12CA9POLB | |
| SCHEMBL27721615 | 0.80 | ALDH1A1 (0.58) | SMN1; SMN2HTTMAPTLMNAALDH1A1 | |
| SCHEMBL5182398 | 0.80 | MMP13 (0.59) | KMT2ACA12CA9MMP9MMP2 | |
| SCHEMBL697477 | 0.78 | MMP2 (0.79) | MAPTALDH1A1POLBMMP9MMP2 | |
| SCHEMBL1203540 | 0.78 | MMP2 (0.79) | MAPTALDH1A1POLBMMP9MMP2 | |
| SCHEMBL697476 | 0.78 | MMP2 (0.79) | MAPTALDH1A1POLBMMP9MMP2 | |
| SCHEMBL13957019 | 0.77 | MMP9 (0.66) | SMN1; SMN2MAPTALDH1A1POLBMMP9 |
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-1034163-A1 | NEW CYSTEINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICALS CONTAINING THEM | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. Berlin (DE) | 2000-09-13 | — | — | EP | disclosed |
| WO-1998050351-A1 | NEW CYSTEINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICALS CONTAINING THEM | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V., Berlin (DE) | 1998-11-12 | — | — | WO | disclosed |