Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | FABP6 | P51161 | 1/20 | 0.52 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.50 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.49 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11246587 | 0.90 | CYP1A2 (0.55) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL8283877 | 0.87 | PKN1 (0.64) | CYP1A2LMNACYP3A4MAPTABL1 | |
| SCHEMBL9306377 | 0.85 | PKN1 (0.50) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL4682076 | 0.80 | ALDH1A1 (0.64) | LMNACYP2C9MAPTGAAPKM | |
| SCHEMBL19118043 | 0.79 | TSHR (0.49) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL11540940 | 0.78 | FABP6 (0.58) | ABL1FABP6RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL14046197 | 0.77 | CYP1A2 (0.57) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL9178141 | 0.77 | LMNA (0.52) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL31317898 | 0.77 | LMNA (0.52) | CYP1A2LMNATSHRCYP2C19CYP3A4 | |
| SCHEMBL11148656 | 0.76 | HCRTR1 (0.53) | CYP1A2LMNACYP3A4MAPTPKN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4316021-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1982-02-16 | — | — | US | disclosed |
| US-4243813-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1981-01-06 | — | — | US | disclosed |
| US-4196125-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1980-04-01 | — | — | US | disclosed |
| US-4118573-A | ANTIVIRAL AGENTS | ELI LILLY AND COMPANY (US) | 1978-10-03 | — | — | US | disclosed |
| US-4018790-A | VIRICIDES | ELI LILLY AND COMPANY (US) | 1977-04-19 | — | — | US | disclosed |