Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20124435 | 0.78 | ALDH1A1 (0.34) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL41953 | 0.69 | ALDH1A1 (0.47) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL17970089 | 0.69 | ALDH1A1 (0.47) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL16607543 | 0.69 | ALDH1A1 (0.47) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL22900171 | 0.68 | PPOX (0.37) | ALDH1A1HPGDPOLBTDP1L3MBTL1 | |
| SCHEMBL11861628 | 0.67 | CA12 (0.30) | CA9CA12CA1CA2 | |
| SCHEMBL8255299 | 0.66 | CA12 (0.32) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL13841527 | 0.61 | — | — | |
| SCHEMBL8620015 | 0.60 | ALDH1A1 (0.53) | NPSR1ALDH1A1TP53TSHRHSD17B10 | |
| SCHEMBL21449886 | 0.60 | ALDH1A1 (0.47) | NPSR1ALDH1A1TP53TSHRHSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3299370-B1 | CRYSTALLINE FORMS OF DIAZABICYCLOOCTANE DERIVATIVE AND PRODUCTION PROCESS THEREOF | MEIJI SEIKA PHARMA CO LTD (JP) | 2021-11-24 | — | — | EP | disclosed |