Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11516708 | 0.85 | MAPT (0.42) | CES2CES1MAPTOPRM1OPRL1 | |
| SCHEMBL8435728 | 0.83 | CES2 (0.41) | CES2CES1MAPTOPRM1OPRL1 | |
| SCHEMBL9341835 | 0.83 | CES2 (0.41) | CES2CES1MAPTOPRM1OPRL1 | |
| SCHEMBL9148153 | 0.81 | MAPT (0.42) | CES2CES1MAPTOPRM1OPRL1 | |
| SCHEMBL3069583 | 0.76 | ESR1 (0.37) | CES2CES1MAPTOPRM1OPRL1 | |
| SCHEMBL14760301 | 0.72 | CES2 (0.48) | CES2CES1MAPTALDH1A1GLA | |
| SCHEMBL2276954 | 0.71 | ESR1 (0.37) | MAPTOPRM1OPRL1ALDH1A1TSHR | |
| SCHEMBL14760071 | 0.67 | CES2 (0.48) | CES2CES1MAPTALDH1A1GLA | |
| SCHEMBL1130961 | 0.67 | CES2 (0.48) | CES2CES1MAPTALDH1A1GLA | |
| SCHEMBL11408419 | 0.67 | ALDH1A1 (0.41) | CES2CES1MAPTOPRM1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4159267-A | Novel silyl ester azetidine-2-sulfenate intermediates and process for preparing desacetoxycephalosporins | ELI LILLY AND COMPANY (US) | 1979-06-26 | — | — | US | disclosed |
| US-3944545-A | Process for preparing desacetoxycephalosporins | ELI LILLY AND COMPANY (US) | 1976-03-16 | — | — | US | disclosed |