Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | UBE2N | P61088 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 6/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6947814 | 0.85 | LMNA (0.53) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL6948113 | 0.80 | MAPT (0.45) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL6950123 | 0.79 | KMT2A (0.49) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL6946183 | 0.78 | LTA4H (0.52) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL27456264 | 0.77 | TUBB4A (0.59) | — | |
| SCHEMBL6947629 | 0.75 | MAPT (0.56) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL6946935 | 0.75 | CNR2 (0.47) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| SCHEMBL6951319 | 0.74 | ERCC5 (0.39) | KMT2AALDH1A1KDM4EGAALMNA | |
| SCHEMBL17813141 | 0.74 | KMT2A (0.67) | KMT2AMEN1MAPTALDH1A1KDM4E | |
| Diphenylmethane SCHEMBL28092535 | 0.73 | CALM1 (0.63) | MAPTKDM4ETSHRLMNAL3MBTL1 |
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 |