Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4959184 | 0.89 | BRD4 (0.44) | BRD4MMP2TSHRLMNATP53 | |
| SCHEMBL4960654 | 0.82 | CHRM2 (0.44) | BRD4KMT2AMEN1CHEK1GLO1 | |
| SCHEMBL14594976 | 0.77 | BRD4 (0.69) | BRD4MMP2TSHRLMNATP53 | |
| SCHEMBL14594982 | 0.74 | BRD4 (0.43) | BRD4MMP2TSHRLMNATP53 | |
| SCHEMBL4959114 | 0.74 | BRD4 (0.43) | BRD4MMP2TSHRLMNATP53 | |
| SCHEMBL4960991 | 0.73 | RIPK1 (0.50) | KMT2AMEN1CHEK1MAPTKDM4E | |
| SCHEMBL4960536 | 0.73 | EGFR (0.37) | BRD4KMT2AKDM4EHPGDCYP1A2 | |
| SCHEMBL4958627 | 0.72 | MEN1 (0.42) | BRD4KMT2AMEN1CHEK1SMN1; SMN2 | |
| SCHEMBL4960713 | 0.70 | CHEK1 (0.49) | LMNAHTTKMT2AMEN1CHEK1 | |
| SCHEMBL14594938 | 0.70 | ALK (0.51) | — |
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-1896472-A1 | ALPHA-CARBOLINES AS CDK-1 INHIBITORS | Boehringer Ingelheim International GmbH (DE) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006131552-A1 | ALPHA-CARBOLINES AS CDK-1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2006-12-14 | — | — | WO | disclosed |