Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 4/20 | 0.45 |
| ▸ | RXRB | P28702 | 4/20 | 0.45 |
| ▸ | RXRG | P48443 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL166878 | 0.83 | RXRB (0.59) | RXRARXRBRXRGDHODHTDP1 | |
| SCHEMBL14534692 | 0.82 | DHODH (0.60) | RXRARXRBRXRGDHODHTDP1 | |
| Hydrochloric Acid SCHEMBL11879619 | 0.81 | RXRB (0.57) | RXRARXRBRXRGDHODHTDP1 | |
| Hydrochloric Acid SCHEMBL4585979 | 0.81 | RXRB (0.57) | RXRARXRBRXRGDHODHTDP1 | |
| Water SCHEMBL28383353 | 0.81 | RXRB (0.57) | RXRARXRBRXRGDHODHTDP1 | |
| SCHEMBL8168277 | 0.81 | HDAC3 (0.46) | RXRARXRBRXRGTDP1TP53 | |
| Hydrochloric Acid SCHEMBL8505491 | 0.79 | HDAC3 (0.45) | RXRARXRBRXRGTDP1TP53 | |
| SCHEMBL501957 | 0.79 | RXRB (0.64) | RXRARXRBRXRGDHODHTDP1 | |
| SCHEMBL6362506 | 0.78 | RXRA (0.50) | RXRARXRBRXRGDHODHTDP1 | |
| SCHEMBL5873298 | 0.77 | RXRB (0.62) | RXRARXRBRXRGDHODHTDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5731350-A | Substituted benzenedicarboxylic acid diguanides, process for their preparation, their use as a medicament or diagnostic, and medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-03-24 | — | — | US | claimed |
| JP-9169718-A | — | — | None | — | — | JP | disclosed |
| US-5731350-A | Substituted benzenedicarboxylic acid diguanides, process for their preparation, their use as a medicament or diagnostic, and medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-03-24 | — | — | US | disclosed |
| JP-H09169718-A | SUBSTITUTED BENZENEDICARBOXYLIC ACID DIGUANIDIDE, ITS PRODUCTION, USE OF THE SAME COMPOUND AS MEDICINE OR DIAGNOSING AGENT AND MEDICINE CONTAINING THE SAME | HOECHST AG | 1997-06-30 | — | — | JP | disclosed |