Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.45 |
| ▸ | CASP2 | P42575 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 3/20 | 0.38 |
| ▸ | PPARD | Q03181 | 3/20 | 0.38 |
| ▸ | PPARA | Q07869 | 3/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.38 |
| ▸ | TLR2 | O60603 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30255194 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL3856282 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL30812349 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL29437846 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL3850619 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL6889519 | 0.98 | EPHX1 (0.48) | KDM4CEPHX1CASP2ALOX15TSHR | |
| Hydrochloric Acid SCHEMBL11673567 | 0.96 | EPHX1 (0.47) | KDM4CEPHX1CASP2ALOX15TSHR | |
| SCHEMBL28370224 | 0.93 | KDM4C (0.48) | KDM4CEPHX1AKR1B1ALOX15 | |
| SCHEMBL23948699 | 0.84 | KDM4C (0.57) | KDM4CEPHX1ALOX15TSHRALDH1A1 | |
| Glycinebetaine SCHEMBL4800074 | 0.82 | CPT2 (0.40) | KDM4CEPHX1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2010549-A1 | CRYSTALLINE FORMS OF IBANDRONIC ACID AND PROCESSES FOR PREPARATION THEREOF | Teva Pharmaceutical Industries Ltd (IL) | 2009-01-07 | — | — | EP | claimed |
| WO-2007127249-A1 | CRYSTALLINE FORMS OF IBANDRONIC ACID AND PROCESSES FOR PREPARATION THEREOF | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2007-11-08 | — | — | WO | claimed |
| US-4280008-A | CHEMICAL INTERMEDIATES FOR OPTICALLY ACTIVE AMINO ACIDS | BASF AKTIENGESELLSCHAFT (DE) | 1981-07-21 | — | — | US | disclosed |