Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | TNF | P01375 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9035239 | 0.95 | KDM4E (0.72) | KDM4EALDH1A1TNIKL3MBTL1HRH3 | |
| SCHEMBL18925150 | 0.86 | HDAC6 (0.58) | KDM4EALDH1A1TNIKSMN1; SMN2GAA | |
| SCHEMBL30486118 | 0.86 | RAB9A (0.70) | KDM4EALDH1A1TNIKL3MBTL1SMN1; SMN2 | |
| SCHEMBL30860319 | 0.83 | ALDH1A1 (0.54) | KDM4EALDH1A1TNIKL3MBTL1HRH3 | |
| SCHEMBL15156423 | 0.79 | KDM4E (1.00) | KDM4EALDH1A1TNIKL3MBTL1HRH3 | |
| SCHEMBL10515943 | 0.78 | CDK5 (0.56) | ALDH1A1SMN1; SMN2POLBCHEK1 | |
| SCHEMBL6224393 | 0.77 | HRH3 (0.55) | KDM4EALDH1A1L3MBTL1HRH3SMN1; SMN2 | |
| SCHEMBL7008043 | 0.75 | KDM4E (0.67) | KDM4EALDH1A1TNIKL3MBTL1HRH3 | |
| SCHEMBL25230264 | 0.74 | NPC1 (0.61) | ALDH1A1GAANPC1LMNAKMT2A | |
| SCHEMBL694950 | 0.74 | RAB9A (0.73) | KDM4EALDH1A1L3MBTL1HRH3SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015049325-A1 | THERAPEUTIC INHIBITORS OF CDK8 AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2015-04-09 | — | — | WO | disclosed |