Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CELA1 | Q9UNI1 | 1/20 | 0.48 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.46 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.46 |
| ▸ | ALDH1B1 | P30837 | 1/20 | 0.46 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31262945 | 0.81 | KDM4E (0.71) | CELA1HSD17B3MAOBALDH2ALDH1A1 | |
| SCHEMBL8199613 | 0.81 | KDM4E (0.71) | CELA1HSD17B3MAOBALDH2ALDH1A1 | |
| SCHEMBL27617272 | 0.78 | HSD17B3 (0.61) | HSD17B3MAOBALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL7485171 | 0.77 | RAB9A (0.47) | MAOBALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL8807724 | 0.73 | MAOB (0.60) | HSD17B3MAOBALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL9211053 | 0.72 | MCL1 (0.63) | HSD17B3MAOBALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL18752500 | 0.72 | KDM4E (0.63) | MAOBALDH1A1KDM4EHPGDGPR35 | |
| SCHEMBL1109633 | 0.72 | CA12 (0.65) | ALDH1A1KDM4EHPGDHTTPOLB | |
| SCHEMBL1538335 | 0.70 | CA12 (0.63) | ALDH1A1KDM4EHPGDHTTPOLB | |
| SCHEMBL8980551 | 0.69 | CA12 (0.57) | ALDH1A1KDM4EHPGDHTTPOLB |
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 |