Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16217696 | 0.87 | ALDH1A1 (0.46) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL79588 | 0.86 | ALDH1A1 (0.56) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL28293945 | 0.86 | ALDH1A1 (0.56) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL17960733 | 0.85 | ALDH1A1 (0.44) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| Ammonia Solution, Strong SCHEMBL28294025 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL28099320 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL17973521 | 0.82 | CYP2D6 (0.44) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL13269637 | 0.81 | ALDH1A1 (0.56) | ALDH1A1MAPTTSHRNPSR1GLO1 | |
| SCHEMBL13804366 | 0.80 | ALDH1A1 (0.32) | ALDH1A1MAPT | |
| Acetic Acid SCHEMBL28826956 | 0.79 | ALDH1A1 (0.55) | ALDH1A1MAPTTSHRNPSR1GLO1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0368668-B1 | Antibody-drug conjugates | LILLY CO ELI (US) | 1997-01-02 | — | — | EP | disclosed |
| US-5514794-A | DERIVATIZED DRUGS WITH MALONATE LINKER, THE DRUG BEING LINKED THROUGH METHYLENE TO THE 2-POSITION CARBON OF MALONATE; THESE ARE INTERMEDIATES FOR THE CONJUGATES | ELI LILLY AND COMPANY (US) | 1996-05-07 | — | — | US | disclosed |
| US-5010176-A | Malonate linker | ELI LILLY AND COMPANY (US) | 1991-04-23 | — | — | US | disclosed |
| EP-0368668-A2 | Antibody-drug conjugates | ELI LILLY AND COMPANY (US) | 1990-05-16 | — | — | EP | disclosed |