Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.41 |
| ▸ | CAD | P27708 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20166210 | 1.00 | MMP8 (0.41) | MMP8CADL3MBTL1HTTCYP1A2 | |
| SCHEMBL19088625 | 0.85 | CA2 (0.37) | MMP8KMT2APOLBALDH1A1SMN1; SMN2 | |
| SCHEMBL16346757 | 0.82 | CAD (0.39) | MMP8CADL3MBTL1HTTCYP1A2 | |
| SCHEMBL20166234 | 0.80 | CTSL (0.36) | KMT2AALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL18248048 | 0.80 | CTSL (0.36) | KMT2AALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL20166237 | 0.80 | CTSL (0.36) | KMT2AALDH1A1SMN1; SMN2MAPTLMNA | |
| Hydrochloric Acid SCHEMBL20166215 | 0.79 | CTSL (0.35) | ALDH1A1SMN1; SMN2MAPT | |
| Hydrochloric Acid SCHEMBL20166214 | 0.79 | CTSL (0.35) | ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL16376523 | 0.78 | CYP1A2 (0.58) | HTTCYP1A2CYP2C9CYP2C19GAA | |
| Hydrochloric Acid SCHEMBL20166212 | 0.77 | CTSL (0.35) | ALDH1A1SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3922639-A1 | ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS | Boehringer Ingelheim Animal Health USA Inc. (US) | 2021-12-15 | — | — | EP | disclosed |
| WO-2021147882-A1 | DIBENZOFURAN DERIVATIVE CATHEPSIN K INHIBITOR, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 深圳信立泰药业股份有限公司 | 2021-07-29 | — | — | WO | disclosed |