Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | KCNQ3 | O43525 | 6/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 6/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 6/20 | 0.42 |
| ▸ | KCNQ1 | P51787 | 6/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7676637 | 0.80 | KMT2A (0.39) | NAPRTCES2BCHECES1KCNQ3 | |
| SCHEMBL7679465 | 0.80 | KMT2A (0.39) | NAPRTCES2BCHECES1KCNQ3 | |
| SCHEMBL7440808 | 0.76 | NAPRT (0.72) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL10633441 | 0.76 | KCNQ3 (0.49) | NAPRTCES2CES1KCNQ3KCNQ2 | |
| SCHEMBL7514511 | 0.75 | KCNQ3 (0.60) | KCNQ3KCNQ2KCNE1KCNQ1BACE1 | |
| SCHEMBL3440833 | 0.74 | CES2 (0.74) | CES2BCHECES1GAAKMT2A | |
| SCHEMBL16460479 | 0.74 | KCNQ3 (0.62) | NAPRTCES2CES1KCNQ3KCNQ2 | |
| SCHEMBL8175947 | 0.74 | CES2 (0.57) | CES2BCHECES1GAAKMT2A | |
| SCHEMBL4467915 | 0.74 | NPC1 (0.62) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL20709029 | 0.74 | CES2 (0.57) | CES2BCHECES1TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1077701-A4 | ANTI-VIRAL COMPOUNDS | LILLY CO ELI (US) | 2002-03-20 | — | — | EP | disclosed |
| US-6358971-B1 | FOR INHIBITING THE GROWTH OF A PICORNAVIRUS | ELI LILLY AND COMPANY | 2002-03-19 | — | — | US | disclosed |
| EP-1077701-A1 | ANTI-VIRAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059587-A1 | ANTI-VIRAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 1999-11-25 | — | — | WO | disclosed |