Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6877246 | 0.84 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL3368347 | 0.81 | ALDH1A1 (0.48) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL1866781 | 0.80 | ALDH1A1 (0.58) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL3369832 | 0.80 | KDM4E (0.50) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL4849077 | 0.79 | ALDH1A1 (0.76) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL6878529 | 0.78 | ALDH1A1 (0.59) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL3159704 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL11785304 | 0.76 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL5125304 | 0.75 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA | |
| SCHEMBL8398079 | 0.75 | FOS (0.59) | ALDH1A1KDM4EMAPTSMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | disclosed |
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | disclosed |