Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GLA | P06280 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | STAT3 | P40763 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.43 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | MAX | P61244 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11058494 | 0.81 | ALDH1A1 (0.49) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL8204954 | 0.77 | MYC (0.59) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL27961722 | 0.76 | MAPT (0.47) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL19260553 | 0.75 | MAOA (0.67) | ALDH1A1GLAHPGDACHEKDM4E | |
| SCHEMBL29565947 | 0.75 | MAOA (0.67) | ALDH1A1GLAHPGDACHEKDM4E | |
| SCHEMBL31410084 | 0.73 | ALDH1A1 (0.52) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL5387138 | 0.73 | ALDH1A1 (0.52) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL4047506 | 0.73 | NQO2 (0.53) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL1504343 | 0.73 | ALDH1A1 (0.52) | ALDH1A1GLAHPGDMAPTACHE | |
| SCHEMBL189031 | 0.72 | ALDH1A1 (0.60) | ALDH1A1GLAHPGDMAPTACHE |
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-3416963-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | Global Blood Therapeutics, Inc. (US) | 2018-12-26 | — | — | EP | disclosed |
| WO-2017142947-A1 | HISTONE METHYLTRANSFERASE INHIBITORS | GLOBAL BLOOD THERAPEUTICS, INC. (US) | 2017-08-24 | — | — | WO | disclosed |