Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | PER2 | O15055 | 1/20 | 0.39 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.39 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3460745 | 0.83 | ALDH1A1 (0.40) | EPHX2GAAALDH1A1TSHR | |
| SCHEMBL10282277 | 0.73 | SMN1; SMN2 (0.52) | USP30KMT2ACYP2C19 | |
| SCHEMBL12207836 | 0.73 | CA1 (0.43) | USP30ALDH1A1TSHR | |
| SCHEMBL15644903 | 0.71 | USP30 (0.62) | USP30ALDH1A1 | |
| SCHEMBL20970042 | 0.71 | USP30 (0.62) | USP30ALDH1A1 | |
| SCHEMBL15644901 | 0.71 | USP30 (0.62) | USP30ALDH1A1 | |
| SCHEMBL20986645 | 0.71 | USP30 (0.56) | USP30BRD4 | |
| SCHEMBL20986647 | 0.71 | USP30 (0.56) | USP30BRD4 | |
| SCHEMBL11731985 | 0.71 | TSHR (0.47) | USP30KMT2AALDH1A1LMNATSHR | |
| SCHEMBL19493611 | 0.71 | RAB9A (0.62) | KMT2AALDH1A1LMNAHPGDHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| US-7101891-B2 | Compounds and pharmaceutical compositions for inhibiting MRP1 | ELI LILLY AND COMPANY (US) | 2006-09-05 | — | — | US | disclosed |
| US-20040116460-A1 | Compounds and pharmaceutical compositions for inhibiting mrp1 | COHEN JEFFREY DANIEL (US) | 2004-06-17 | — | — | US | disclosed |
| EP-1392701-A1 | COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING MRP1 | ELI LILLY AND COMPANY (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002081480-A1 | COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING MRP1 | ELI LILLY AND COMPANY (US) | 2002-10-17 | — | — | WO | disclosed |