Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 13/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | BCL2 | P10415 | 2/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.42 |
| ▸ | F13A1 | P00488 | 1/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | TGM1 | P22735 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182745 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL6847610 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL8166919 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL6847613 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL2819569 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL25097911 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL6847935 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL4320166 | 0.88 | NR1H2 (0.47) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL6847660 | 0.87 | MCL1 (0.46) | MCL1CYP1A2POLBCYP3A4CYP2C19 | |
| SCHEMBL13481726 | 0.87 | MCL1 (0.44) | MCL1CYP1A2POLBCYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |