Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | CTSK | P43235 | 6/20 | 0.57 |
| ▸ | CTSB | P07858 | 3/20 | 0.57 |
| ▸ | CTSS | P25774 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CTSL | P07711 | 3/20 | 0.53 |
| ▸ | CCR1 | P32246 | 1/20 | 0.52 |
| ▸ | ELANE | P08246 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11431644 | 0.88 | ALDH1A1 (0.61) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL11436545 | 0.86 | ALDH1A1 (0.59) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL19126034 | 0.84 | ELANE (0.51) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL3048876 | 0.84 | ELANE (0.51) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL3048884 | 0.84 | ELANE (0.51) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL3048881 | 0.84 | ELANE (0.51) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL7856547 | 0.84 | CAPN1 (0.52) | ALDH1A1EPHX1CYP3A4TSHRMAPT | |
| SCHEMBL28758715 | 0.83 | CTSL (0.51) | ALDH1A1CYP3A4TSHRMAPTCTSK | |
| SCHEMBL10453618 | 0.82 | CASP3 (0.61) | CTSKCTSBCTSSMEN1KMT2A | |
| SCHEMBL19557810 | 0.82 | CASP3 (0.61) | CTSKCTSBCTSSMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0561637-B1 | A catalyst for asymmetric induction | SUMITOMO CHEMICAL CO (JP) | 1997-02-26 | — | — | EP | disclosed |
| US-5308820-A | Catalyst for asymmetric induction | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1994-05-03 | — | — | US | disclosed |
| EP-0561637-A2 | A catalyst for asymmetric induction | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-09-22 | — | — | EP | disclosed |