Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11233575 | 0.80 | CA2 (0.46) | AKR1B1ALDH1A1KMT2ATSHRKDM4E | |
| SCHEMBL9734939 | 0.79 | AKR1B1 (0.50) | AKR1B1ALDH1A1KMT2AKDM4EAPEX1 | |
| SCHEMBL13267956 | 0.77 | NPC1 (0.54) | AKR1B1ALDH1A1KMT2AKDM4EMEN1 | |
| SCHEMBL9522504 | 0.75 | KDM4E (0.43) | ALDH1A1KMT2ATSHRKDM4ELMNA | |
| SCHEMBL7324404 | 0.72 | ALDH1A1 (0.50) | AKR1B1ALDH1A1KMT2ATSHRKDM4E | |
| SCHEMBL463115 | 0.72 | — | — | |
| SCHEMBL9224894 | 0.70 | CRHBP (0.43) | AKR1B1ALDH1A1KMT2AKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL6546580 | 0.70 | ALDH1A1 (0.48) | AKR1B1ALDH1A1KMT2ATSHRKDM4E | |
| Bromide SCHEMBL27471439 | 0.70 | ALDH1A1 (0.48) | AKR1B1ALDH1A1KMT2ATSHRKDM4E | |
| SCHEMBL14865350 | 0.70 | AKR1B1 (0.55) | AKR1B1ALDH1A1KDM4ELMNAMAPT |
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-0238061-B1 | CEPHALOSPORIN DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND ANTIBACTERIAL AGENTS | Banyu Pharmaceutical Co., Ltd. (JP) | 1992-10-21 | — | — | EP | disclosed |
| US-4988687-A | Thiazoleoxyimineacetamido carboxymethylpyridinium derivatives of cephalosporins | BANYU PHARMACEUTICAL COMPANY, LTD. (JP) | 1991-01-29 | — | — | US | disclosed |
| US-4880797-A | THIAZOLE DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1989-11-14 | — | — | US | disclosed |