Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | PKM | P14618 | 2/20 | 0.58 |
| ▸ | CRHBP | P24387 | 1/20 | 0.58 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.55 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1304734 | 0.89 | KMT2A (0.60) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL7052691 | 0.89 | LMNA (0.64) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL19211658 | 0.89 | KMT2A (0.61) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL1978638 | 0.88 | KMT2A (0.58) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL6336196 | 0.87 | LMNA (0.61) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL5882061 | 0.86 | VCAM1 (0.57) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL4262486 | 0.85 | KMT2A (0.61) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL3127542 | 0.85 | KMT2A (0.61) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL6704626 | 0.84 | KMT2A (0.60) | KMT2AALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL310490 | 0.84 | KMT2A (0.60) | KMT2AALDH1A1KDM4EPOLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2111406-A1 | SUBSTITUTED SPIROCHROMANONE DERIVATIVES AS ACC INHIBITORS | Merck & Co., Inc. (US) | 2009-10-28 | — | — | EP | disclosed |
| WO-2008088688-A1 | SUBSTITUTED SPIROCHROMANONE DERIVATIVES AS ACC INHIBITORS | MERCK & CO., INC. (US) | 2008-07-24 | — | — | WO | disclosed |