Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1626657 | 0.86 | CNR2 (0.48) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL19183403 | 0.84 | MAPT (0.49) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL833293 | 0.84 | CHRM2 (0.65) | CHRM2MAPTKMT2ACYP1A2LMNA | |
| SCHEMBL2396473 | 0.82 | MAPT (0.50) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL29156932 | 0.81 | CHRM2 (0.64) | CHRM2CYP2C19NPSR1CHRM4CHRM1 | |
| SCHEMBL22164189 | 0.81 | MAPT (0.46) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL11844527 | 0.80 | MAPT (0.43) | MAPTKMT2AMEN1CYP1A2LMNA | |
| Hydrochloric Acid SCHEMBL17825610 | 0.80 | MAPT (0.43) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL29571318 | 0.80 | MAPT (0.46) | MAPTKMT2AMEN1CYP1A2LMNA | |
| SCHEMBL17825606 | 0.79 | MAPT (0.45) | MAPTKMT2AMEN1CYP1A2LMNA |
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-1322599-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2001096283-A9 | HIV INTEGRASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2002-10-17 | — | — | WO | disclosed |
| WO-2001096283-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-12-20 | — | — | WO | disclosed |