Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24137901 | 0.80 | LMNA (0.51) | KMT2AMEN1PKMALDH1A1MAPT | |
| SCHEMBL9911482 | 0.77 | GAA (0.46) | KMT2AALDH1A1MAPTNLRP1GAA | |
| SCHEMBL6510629 | 0.74 | ALDH1A1 (0.59) | KMT2AMEN1PKMALDH1A1MAPT | |
| SCHEMBL9911453 | 0.70 | KMT2A (0.53) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL19634841 | 0.70 | NOTUM (0.53) | KMT2AMEN1PKMALDH1A1LMNA | |
| SCHEMBL22544884 | 0.68 | KMT2A (0.50) | KMT2AMEN1ALDH1A1LMNAGAA | |
| SCHEMBL6623667 | 0.67 | PKM (0.49) | KMT2AMEN1PKMALDH1A1MAPT | |
| SCHEMBL13867734 | 0.67 | TDP1 (0.52) | KMT2AMEN1ALDH1A1MAPTLMNA | |
| SCHEMBL9835275 | 0.66 | MEN1 (0.45) | KMT2AMEN1ALDH1A1KDM1ACA12 | |
| SCHEMBL9329532 | 0.65 | PKM (0.47) | KMT2AMEN1PKMALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-8198458-B2 | Non-nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-12 | — | — | US | disclosed |
| US-7300948-B2 | Alkynyl compounds as non nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-11-27 | — | — | US | disclosed |