Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP14 | P50281 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 4/20 | 0.37 |
| ▸ | KCNJ11 | Q14654 | 3/20 | 0.36 |
| ▸ | CMA1 | P23946 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | G6PD | P11413 | 1/20 | 0.35 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.35 |
| ▸ | CTSG | P08311 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7358348 | 0.81 | ALDH1A1 (0.43) | CA12CA2MMP2MMP9MMP8 | |
| SCHEMBL7357998 | 0.79 | CA12 (0.48) | CA12CA2MMP2MMP9MMP8 | |
| SCHEMBL680370 | 0.78 | AKR1B1 (0.40) | KCNJ11NPC1RAB9AKDM4EG6PD | |
| SCHEMBL7355497 | 0.76 | ACP3 (0.42) | CA12CA2MMP2MMP9MMP8 | |
| SCHEMBL4430656 | 0.75 | CA12 (0.71) | CA12CA2MMP2MMP9MMP8 | |
| SCHEMBL8621279 | 0.73 | ALDH1A1 (0.36) | CA2KCNJ11RAB9AKDM4EG6PD | |
| SCHEMBL21555507 | 0.70 | ALDH1A1 (0.46) | NPC1RAB9AKDM4EG6PDNCEH1 | |
| SCHEMBL7358973 | 0.70 | HSP90AA1 (0.49) | CA12CA2MMP2MMP9MMP8 | |
| Phosphonic Acid SCHEMBL27297809 | 0.69 | KCNJ11 (0.39) | KCNJ11NPC1RAB9AKDM4EG6PD | |
| SCHEMBL27338316 | 0.68 | ALDH1A1 (0.37) | CA2ALDH1A1CYP3A4HPGDTSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6288065-B1 | CENTRAL NERVOUS SYSTEM DISORDERS; PARKINSON*S AND ALZHEIMER*S DISEASE | SCHERING AKTIENGESEELLSCHAFT (DE) | 2001-09-11 | — | — | US | disclosed |
| US-6057304-A | Quinoxaline-phosphonic acid derivatives | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-05-02 | — | — | US | disclosed |
| CN-1038840-C | para-dinitrogen naphthalene derivative, its preparation method and its medical use | SCHERING AG (DE) | 1998-06-24 | — | — | CN | disclosed |
| EP-0565683-A1 | QUINOXALINE DERIVATES WITH AFFINITY FOR QUISQUALATE-RECEPTORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-10-20 | — | — | EP | disclosed |
| CN-1072929-A | Para-dinitronaphthalene derivative, preparation method and medical application thereof | SCHERING AG (DE) | 1993-06-09 | — | — | CN | disclosed |
| WO-1993008173-A1 | QUINOXALINE DERIVATES WITH AFFINITY FOR QUISQUALATE-RECEPTORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-04-29 | — | — | WO | disclosed |