Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9080409 | 0.88 | TSHR (0.43) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL3552508 | 0.83 | NPC1 (0.39) | KDM4EALDH1A1NPC1RAB9AHSD17B10 | |
| SCHEMBL9081244 | 0.82 | ALDH1A1 (0.38) | KDM4EALDH1A1NPC1GAAHSD17B10 | |
| SCHEMBL18779362 | 0.81 | KDM4E (0.59) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL14286158 | 0.80 | ACHE (0.36) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL3550205 | 0.80 | AMPD3 (0.40) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL11955735 | 0.80 | KDM4E (0.47) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL3303470 | 0.79 | KDM4E (0.43) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL9082155 | 0.79 | TSHR (0.36) | KDM4EALDH1A1NPC1RAB9AGAA | |
| SCHEMBL12533716 | 0.78 | STS (0.36) | DRD2DRD3DRD1DRD4DRD5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000078724-A2 | IMIDAZOLINDERIVATIVES THEIR PREPARATION AND THEIR PHARMACEUTICAL USE | ELI LILLY AND COMPANY (US) | 2000-12-28 | — | — | WO | disclosed |