Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | F10 | P00742 | 2/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.43 |
| ▸ | ABL1 | P00519 | 5/20 | 0.42 |
| ▸ | BCR | P11274 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.41 |
| ▸ | CFD | P00746 | 2/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31456830 | 0.85 | CYP1A2 (0.46) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL29581125 | 0.85 | CYP1A2 (0.46) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20584698 | 0.81 | KLKB1 (0.52) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20584700 | 0.81 | KLKB1 (0.52) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL29580856 | 0.81 | KLKB1 (0.52) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20584697 | 0.81 | KLKB1 (0.52) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20584573 | 0.81 | KLKB1 (0.51) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20446447 | 0.81 | KLKB1 (0.51) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20584575 | 0.81 | KLKB1 (0.51) | CYP1A2POLBCYP3A4CYP2C19F10 | |
| SCHEMBL20446602 | 0.81 | CYP1A2 (0.43) | CYP1A2POLBCYP3A4CYP2C19F10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3355890-B1 | HUMAN PLASMA KALLIKREIN INHIBITORS | BIOCRYST PHARM INC (US) | 2021-11-10 | — | — | EP | disclosed |