Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.59 |
| ▸ | ALPI | P09923 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | XIAP | P98170 | 1/20 | 0.55 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | LDHA | P00338 | 1/20 | 0.55 |
| ▸ | MMP8 | P22894 | 2/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | CPA1 | P15085 | 2/20 | 0.52 |
| ▸ | CPA3 | P15088 | 2/20 | 0.52 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.52 |
| ▸ | CPB1 | P15086 | 1/20 | 0.52 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.52 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL392827 | 0.91 | CYP1A2 (0.70) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL28314499 | 0.89 | CYP1A2 (0.67) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL27876635 | 0.89 | CYP1A2 (0.67) | CYP1A2MDM2ALPIPKMPTGS1 | |
| Hydrochloric Acid SCHEMBL7304155 | 0.89 | CYP1A2 (0.67) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL28377626 | 0.89 | CYP1A2 (0.67) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL27300438 | 0.83 | ALPI (0.61) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL9833991 | 0.83 | ALPI (0.61) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL1532407 | 0.83 | ALPI (0.61) | CYP1A2MDM2ALPIPKMPTGS1 | |
| SCHEMBL391783 | 0.82 | PPARG (0.61) | CYP1A2MDM2LDHAMMP8SRR | |
| Ether SCHEMBL9554905 | 0.82 | MMP8 (0.57) | CYP1A2MDM2ALPIPKMPTGS1 |
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-4474799-A | Enkephalinase inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1984-10-02 | — | — | US | disclosed |
| US-4474795-A | ANALGESICS, MERCAPTO-ALKANOYL AMINO ACIDS | E. R. SQUIBB & SONS, INC. (US) | 1984-10-02 | — | — | US | disclosed |
| US-4401677-A | Enkephalinase inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1983-08-30 | — | — | US | disclosed |