Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 5/20 | 0.82 |
| ▸ | MMP2 | P08253 | 4/20 | 0.82 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 6/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8408444 | 0.90 | MMP13 (1.00) | MMP13MMP2ALOX15HPGDRECQL | |
| SCHEMBL5261781 | 0.87 | MMP2 (0.62) | MMP13MMP2ALOX15HPGDRECQL | |
| SCHEMBL28593758 | 0.83 | MMP13 (0.67) | MMP13MMP2ALOX15HPGDALDH1A1 | |
| SCHEMBL28687276 | 0.82 | MMP13 (0.81) | MMP13MMP2ALOX15HPGDALDH1A1 | |
| SCHEMBL5261401 | 0.81 | MMP2 (0.54) | MMP13MMP2ALOX15HPGDALDH1A1 | |
| SCHEMBL27785570 | 0.80 | MMP2 (0.53) | MMP13MMP2ALOX15ALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL16402060 | 0.80 | MMP2 (0.53) | MMP13MMP2ALOX15HPGDALDH1A1 | |
| SCHEMBL18332183 | 0.80 | MMP13 (0.67) | MMP13MMP2ALOX15HPGDRECQL | |
| SCHEMBL25810893 | 0.79 | ALOX15 (0.60) | MMP13MMP2ALOX15HPGDALDH1A1 | |
| SCHEMBL20084039 | 0.79 | MMP13 (0.65) | MMP13MMP2ALOX15HPGDRECQL |
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 |
|---|---|---|---|---|---|---|---|
| CN-109748840-B | Synthetic method of 2-substituted indole derivative | 中国医学科学院药物研究所 | 2021-12-07 | — | — | CN | disclosed |