Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.60 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.58 |
| ▸ | TOP2A | P11388 | 6/20 | 0.58 |
| ▸ | TOP2B | Q02880 | 6/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CLK2 | P49760 | 1/20 | 0.55 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9668234 | 0.92 | TOP2A (0.61) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9666037 | 0.89 | ALDH1A1 (0.70) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9666234 | 0.88 | TOP2A (0.61) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL8902351 | 0.88 | ALDH1A1 (0.54) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9670575 | 0.87 | KCNH2 (0.60) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9665913 | 0.87 | KCNH2 (0.71) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9667783 | 0.86 | TOP2A (0.59) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9522707 | 0.86 | ALDH1A1 (0.61) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL9522855 | 0.86 | KCNH2 (0.59) | ALDH1A1POLBOPRM1CHRM2CHRM1 | |
| SCHEMBL10373920 | 0.86 | ALDH1A1 (0.60) | ALDH1A1POLBOPRM1CHRM2CHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0324298-B1 | 7-(1-AZETIDINYL)-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLIC-ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 1992-12-23 | — | — | EP | claimed |
| US-4927926-A | BACTERICIDES | LABORATORIOS DEL DR. ESTEVE S.A. (ES) | 1990-05-22 | — | — | US | disclosed |