Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 8/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6946141 | 0.80 | KMT2A (0.49) | MAPTL3MBTL1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL6946935 | 0.77 | CNR2 (0.47) | MAPTL3MBTL1LMNASMN1; SMN2RAB9A | |
| SCHEMBL29260702 | 0.75 | MGAM (0.41) | MAPTL3MBTL1SMN1; SMN2RAB9AALDH1A1 | |
| Methoxy Aucuparin SCHEMBL8420787 | 0.73 | KDM4E (0.62) | MAPTL3MBTL1SMN1; SMN2ALDH1A1FYN | |
| SCHEMBL6943688 | 0.72 | ALDH1A1 (0.64) | MAPTL3MBTL1LMNASMN1; SMN2RAB9A | |
| SCHEMBL28338665 | 0.71 | HPGD (0.61) | MAPTL3MBTL1LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL7169549 | 0.69 | IKBKB (0.48) | SMN1; SMN2RAB9AALDH1A1FYNKDM4E | |
| Biphenyl SCHEMBL4856272 | 0.69 | ALDH1A1 (0.50) | LMNAALDH1A1HPGDKDM4ETDP1 | |
| SCHEMBL3924409 | 0.69 | MAPT (0.57) | MAPTL3MBTL1LMNASMN1; SMN2RAB9A | |
| SCHEMBL456627 | 0.69 | ABCG2 (0.47) | MAPTL3MBTL1RAB9AALDH1A1FYN |
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 3 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 |
| 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 |