Known targets — ChEMBL curated mechanism
ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1HRH1HTR7IDH1IDH2IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2
The experimentally established mechanism targets of Citric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 6/20 | 0.57 |
| ▸ | ESR2 known ✓ | Q92731 | 5/20 | 0.57 |
| ▸ | PSMB1 | P20618 | 4/20 | 0.61 |
| ▸ | PSMB5 | P28074 | 4/20 | 0.61 |
| ▸ | PSMB2 | P49721 | 3/20 | 0.61 |
| ▸ | LTA4H | P09960 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.49 |
| ▸ | GCGR | P47871 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7443953 | 0.89 | PSMB1 (0.78) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| Water SCHEMBL8476448 | 0.88 | PSMB1 (0.76) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL7451065 | 0.88 | PSMB1 (0.76) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| SCHEMBL4543175 | 0.87 | PSMB1 (0.75) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| Water SCHEMBL8476776 | 0.86 | PSMB1 (0.73) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL8475814 | 0.86 | PSMB1 (0.73) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| SCHEMBL8337044 | 0.83 | KDM4E (0.68) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| SCHEMBL7450424 | 0.82 | KDM4E (0.67) | PSMB1PSMB5PSMB2LTA4HKDM4E | |
| SCHEMBL8641421 | 0.79 | PSMB1 (0.62) | PSMB1PSMB5PSMB2ESR1ESR2 | |
| SCHEMBL7447270 | 0.78 | SMN1; SMN2 (0.61) | PSMB1PSMB5PSMB2LTA4HKDM4E |
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-5962698-A | PLASMINOGEN ACTIVATOR INHIBITOR | ELI LILLY AND COMPANY (US) | 1999-10-05 | — | — | US | disclosed |
| US-5948795-A | PLASMINOGEN ACTIVATOR INHIBITOR | ELI LILLY AND COMPANY (US) | 1999-09-07 | — | — | US | disclosed |