Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 4/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14538282 | 0.85 | ALDH1A1 (0.36) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| SCHEMBL7920680 | 0.78 | GAA (0.37) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| SCHEMBL14748209 | 0.77 | KDM1A (0.39) | HTR2CHTR2BCHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL7923004 | 0.67 | ALDH1A1 (0.37) | GAAHTR2CHTR2BSLC6A2CHRNB2 | |
| SCHEMBL10145621 | 0.65 | HTR2C (0.46) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| SCHEMBL16199826 | 0.65 | ALDH1A1 (0.36) | GAAHTR2CCHRNB2CHRNA4MAPT | |
| SCHEMBL431417 | 0.63 | ADRA2A (0.50) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| SCHEMBL19756620 | 0.63 | GAA (0.37) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| Hydrochloric Acid SCHEMBL4809903 | 0.62 | ADRA2A (0.49) | GAAHTR2CHTR2BHTR1ASLC6A2 | |
| SCHEMBL9582603 | 0.62 | CREBBP (0.42) | GAAHTR2CHTR2BHTR1ASLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004083177-A2 | LINEAR CHAIN SUBSTITUTED MONOCYCLIC AND BICYCLIC DERIVATIVES AS FACTOR XA INHIBITORS | BRYSTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |
| WO-2004083174-A2 | SULFONYL-AMIDINO CONTAINING AND TETRAHYDROPYRIMIDINO CONTAINING COMPOUNDS AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |