Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2586902 | 0.84 | CYP3A4 (0.53) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| Ethaneperoxoic Acid SCHEMBL8378954 | 0.82 | SMN1; SMN2 (0.56) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| SCHEMBL3079874 | 0.81 | SMN1; SMN2 (0.55) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| SCHEMBL3072812 | 0.78 | SMN1; SMN2 (0.55) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| SCHEMBL12844541 | 0.77 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1MAPK1HTR1AADRA1D | |
| SCHEMBL12775941 | 0.76 | SMN1; SMN2 (0.51) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| SCHEMBL266821 | 0.76 | L3MBTL1 (0.64) | SMN1; SMN2L3MBTL1LMNAMAPTCYP3A4 | |
| SCHEMBL29737506 | 0.76 | L3MBTL1 (0.64) | SMN1; SMN2L3MBTL1LMNAMAPTCYP3A4 | |
| SCHEMBL29097497 | 0.75 | L3MBTL1 (0.51) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 | |
| Glycolic Acid SCHEMBL8378550 | 0.75 | ALDH1A1 (0.55) | SMN1; SMN2L3MBTL1LMNAMAPTALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1082121-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2003-02-05 | — | — | EP | disclosed |
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | disclosed |
| EP-1082121-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999062520-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | disclosed |