Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL6538861 | 0.84 | SMN1; SMN2 (0.49) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL24131737 | 0.82 | TSHR (0.52) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL4611409 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL1147121 | 0.77 | — | — | |
| SCHEMBL603784 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL965401 | 0.77 | SMN1; SMN2 (0.73) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL603785 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL21344292 | 0.77 | PRKCA (0.34) | TSHRCYP2C9 | |
| SCHEMBL22146593 | 0.77 | SMN1; SMN2 (0.46) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 | |
| SCHEMBL21400836 | 0.76 | SMN1; SMN2 (0.49) | SMN1; SMN2TSHRALDH1A1LMNAMAPK1 |
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-0532693-A1 | 1,4-DIAMINO-2,3-DIHYDROXYBUTANES | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-03-24 | — | — | EP | disclosed |