Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL31243237 | 1.00 | ALDH1A1 (0.42) | ALDH1A1TP53NOTUMLMNACYP3A4 | |
| SCHEMBL31243236 | 1.00 | ALDH1A1 (0.42) | ALDH1A1TP53NOTUMLMNACYP3A4 | |
| SCHEMBL11702654 | 0.88 | ALDH1A1 (0.45) | ALDH1A1TP53NOTUMLMNACYP3A4 | |
| SCHEMBL15540858 | 0.85 | ALDH1A1 (0.37) | ALDH1A1TP53LMNAMEN1KMT2A | |
| SCHEMBL5430493 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TP53NOTUMLMNACYP3A4 | |
| SCHEMBL6420984 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TP53LMNACYP3A4TRPM8 | |
| SCHEMBL24502417 | 0.81 | SLC6A2 (0.40) | ALDH1A1TP53NOTUMCYP3A4AR | |
| SCHEMBL12301181 | 0.81 | ALDH1A1 (0.56) | ALDH1A1TP53NOTUMLMNACYP3A4 | |
| SCHEMBL2491885 | 0.81 | MEN1 (0.39) | ALDH1A1TP53LMNACYP3A4MEN1 | |
| SCHEMBL25766263 | 0.79 | NOTUM (0.46) | ALDH1A1TP53NOTUMLMNACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1979348-B1 | ANTI-VIRAL COMPOUNDS | ABBOTT LAB (US) | 2012-01-18 | — | — | EP | disclosed |