Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | SORT1 | Q99523 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | RXRA | P19793 | 2/20 | 0.41 |
| ▸ | RXRB | P28702 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8118435 | 0.82 | KDM4E (0.49) | TPMTHSD17B10SORT1KDM4EALDH1A1 | |
| SCHEMBL22114934 | 0.82 | HSD17B10 (0.44) | HSD17B10SORT1KDM4EALDH1A1HPGD | |
| SCHEMBL8116962 | 0.80 | SLC9A1 (0.41) | CFTR | |
| Hydrochloric Acid SCHEMBL8110878 | 0.79 | SLC9A1 (0.40) | CFTR | |
| SCHEMBL21609871 | 0.78 | RXRA (0.47) | HSD17B10SORT1KDM4EALDH1A1HPGD | |
| SCHEMBL8116958 | 0.78 | CFTR (0.36) | TPMTSORT1KDM4ECYP2C19ACLY | |
| SCHEMBL10370336 | 0.78 | TPMT (0.51) | TPMTHSD17B10KDM4EALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL8110876 | 0.77 | CFTR (0.36) | TPMTSORT1KDM4ECYP2C19ACLY | |
| SCHEMBL24837048 | 0.76 | TPMT (0.50) | TPMTHSD17B10KDM4EALDH1A1HPGD | |
| SCHEMBL16676482 | 0.75 | KDM4E (0.50) | HSD17B10KDM4EALDH1A1HPGDRXRA |
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-6153651-A | Ortho-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-11-28 | — | — | US | disclosed |
| EP-0794171-A2 | Orthosubstituted benzoylguanidines, process for their preparation, their use as medicament or diagnostic material and medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-09-10 | — | — | EP | disclosed |