Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | TOP1 | P11387 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CFD | P00746 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.39 |
| ▸ | GAPDH | P04406 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8679604 | 0.88 | TSHR (0.53) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL10767069 | 0.86 | TSHR (0.66) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6550416 | 0.78 | TSHR (0.75) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL2219667 | 0.78 | TSHR (0.64) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL3628967 | 0.78 | TSHR (0.71) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL30154503 | 0.77 | TSHR (1.00) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL640263 | 0.77 | TSHR (1.00) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL2219672 | 0.77 | GAA (0.62) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL8830836 | 0.75 | TSHR (0.70) | TSHRRAB9AKDM4EALDH1A1GAA | |
| SCHEMBL10697221 | 0.75 | TSHR (0.70) | TSHRRAB9AKDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5712268-A | Compositions of tricyclic β-lactams and uses thereof | HOFFMANN-LA ROCHE INC. (US) | 1998-01-27 | — | — | US | disclosed |
| US-5698577-A | ANTIBIOTICS | HOFFMANN-LA ROCHE INC. (US) | 1997-12-16 | — | — | US | disclosed |
| US-5510343-A | BETA-LACTAMASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1996-04-23 | — | — | US | disclosed |