Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 3/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8549896 | 0.73 | CHRNB2 (0.45) | ALDH1A1KMT2AMEN1ESR1ESR2 | |
| SCHEMBL8551515 | 0.73 | ALDH1A1 (0.43) | ALDH1A1KMT2APOLBSMN1; SMN2HTT | |
| SCHEMBL727921 | 0.71 | PARP1 (0.44) | ALDH1A1KMT2APOLBSMN1; SMN2HTT | |
| SCHEMBL8545255 | 0.70 | PARP1 (0.43) | ALDH1A1KMT2APOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29814344 | 0.70 | PARP1 (0.43) | ALDH1A1KMT2APOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29814297 | 0.69 | GPR35 (0.43) | ALDH1A1KMT2ARAB9ASMN1; SMN2HTT | |
| SCHEMBL8550097 | 0.69 | GPR35 (0.43) | ALDH1A1KMT2ARAB9ASMN1; SMN2HTT | |
| SCHEMBL7484667 | 0.69 | ALDH1A1 (0.42) | ALDH1A1KMT2ASMN1; SMN2HTTMEN1 | |
| SCHEMBL8545671 | 0.68 | ALDH1A1 (0.46) | ALDH1A1KMT2APOLBRAB9ASMN1; SMN2 | |
| SCHEMBL10580640 | 0.67 | ALDH1A1 (0.41) | ALDH1A1KMT2APOLBSMN1; SMN2HTT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0736025-B1 | DYHYDROBENZOFURANYL-BIPHENYL CARBOXAMIDES HAVING 5HT1D ANTAGONISTIC ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1998-07-22 | — | — | EP | disclosed |