Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.70 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | GRM5 | P41594 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 2/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | MMP15 | P51511 | 1/20 | 0.47 |
| ▸ | MMP16 | P51512 | 1/20 | 0.47 |
| ▸ | MMP26 | Q9NRE1 | 1/20 | 0.47 |
| ▸ | VCP | P55072 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL400497 | 0.94 | MAPT (0.59) | MAPTSMN1; SMN2LMNAGRM5HPGD | |
| SCHEMBL7252924 | 0.83 | MAPT (1.00) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| SCHEMBL7738989 | 0.83 | MAPT (1.00) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| SCHEMBL51207 | 0.83 | MAPT (1.00) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| SCHEMBL15960257 | 0.82 | RARB (0.63) | MAPTSMN1; SMN2LMNAHPGDALDH1A1 | |
| SCHEMBL28933332 | 0.81 | HPGD (0.50) | MAPTSMN1; SMN2LMNAGRM5HPGD | |
| Water SCHEMBL9631565 | 0.81 | MAPT (0.95) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| Hydrogen Sulfide SCHEMBL28388826 | 0.81 | MAPT (0.95) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| Acetophenone SCHEMBL27985201 | 0.81 | MAPT (0.86) | MAPTSMN1; SMN2HSD17B1LMNAHPGD | |
| SCHEMBL12445832 | 0.80 | MAPT (0.59) | MAPTSMN1; SMN2LMNAALDH1A1CYP1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7790744-B2 | Cyclic peptide antifungal agents and process for preparation thereof | ELI LILLY AND COMPANY (US) | 2010-09-07 | — | — | US | disclosed |
| US-6743777-B1 | TRISPHENYL ACYL DERIVATIVES OF THE ECHINOCANDIN CLASS; CANDIDA ALBICANS; ANTIFUNGAL AND ANTIPARASITIC; CYCLIC HEXAPEPTIDES HAVING UNIQUE SIDE CHAIN ACYL GROUP | ELI LILLY AND COMPANY | 2004-06-01 | — | — | US | disclosed |