Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | CPS1 | P31327 | 2/20 | 0.36 |
| ▸ | PDE2A | O00408 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL9018666 | 0.92 | PIM1 (0.40) | PDE2AKMT2ACHEK1PARP10EPHX2 | |
| SCHEMBL8610216 | 0.88 | MRGPRX4 (0.39) | CFTRMRGPRX4ABL1KMT2AALDH1A1 | |
| SCHEMBL20644248 | 0.87 | CFTR (0.46) | CFTRMRGPRX4ABL1CPS1PDE2A | |
| SCHEMBL8609955 | 0.84 | CFTR (0.57) | CFTRMRGPRX4ALDH1A1KDM4EGAA | |
| SCHEMBL8610122 | 0.82 | SLC9A1 (0.40) | CFTRMRGPRX4 | |
| SCHEMBL9018732 | 0.81 | FFAR4 (0.40) | ABL1KMT2ACHEK1EPHX2PIM1 | |
| SCHEMBL8614095 | 0.81 | MRGPRX4 (0.38) | CFTRMRGPRX4ABL1CHEK1EPHX2 | |
| SCHEMBL8614188 | 0.81 | MRGPRX4 (0.40) | CFTRMRGPRX4KMT2AKDM4EGAA | |
| SCHEMBL8612520 | 0.80 | SLC9A1 (0.40) | MRGPRX4PDE2A | |
| SCHEMBL8612355 | 0.78 | TDP1 (0.47) | MRGPRX4KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5747539-A | Fluorine-containing benzoylguanidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-05-05 | — | — | US | disclosed |