Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733895 | 0.86 | PDK2 (0.39) | CASP3ALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9733622 | 0.79 | POLB (0.35) | CASP3POLBLMNA | |
| SCHEMBL10695615 | 0.79 | MAPT (0.40) | CASP3ALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9733908 | 0.78 | OPRM1 (0.36) | CASP3ALDH1A1ATMSMN1; SMN2NPSR1 | |
| SCHEMBL9733799 | 0.75 | MAPT (0.40) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| SCHEMBL9733318 | 0.73 | S100A4 (0.38) | PDK2MAPTRAB9A | |
| SCHEMBL9734695 | 0.73 | KMT2A (0.40) | ALDH1A1TDP1PDK2MAPTMEN1 | |
| SCHEMBL10433122 | 0.73 | F10 (0.40) | ALDH1A1SMN1; SMN2KDM4EPDK2HSD17B10 | |
| SCHEMBL10433092 | 0.72 | F10 (0.36) | — | |
| SCHEMBL2946109 | 0.72 | CA1 (0.53) | ALDH1A1SMN1; SMN2KDM4ETDP1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5132307-A | TETRALIN COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-21 | — | — | US | disclosed |
| EP-0368160-A1 | Tetralin derivatives | MERCK PATENT GmbH (DE) | 1990-05-16 | — | — | EP | disclosed |