Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | CFTR | P13569 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9664845 | 0.88 | KMT2A (0.50) | ALDH1A1HSD17B10CFTRKMT2APTGS1 | |
| SCHEMBL28996258 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10CFTRKMT2AADRA2B | |
| SCHEMBL7976422 | 0.81 | CA1 (0.47) | ALDH1A1KMT2AADRA2BPTGS1TDP1 | |
| SCHEMBL11330367 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CFTRKMT2AADRA2B | |
| SCHEMBL2635055 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CFTRKMT2APTGS1 | |
| SCHEMBL7203924 | 0.81 | AAK1 (0.39) | ALDH1A1HSD17B10CFTRKMT2AADRA2B | |
| SCHEMBL15670602 | 0.80 | KMT2A (0.47) | ALDH1A1KMT2APOLB | |
| SCHEMBL1159853 | 0.80 | CASP1 (0.44) | ALDH1A1KMT2A | |
| SCHEMBL21296572 | 0.80 | CYP2C19 (0.44) | ALDH1A1KMT2APOLBCYP3A4 | |
| SCHEMBL15670601 | 0.80 | KMT2A (0.47) | ALDH1A1KMT2APOLB |
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-5719141-A | HYPOTENSIVE AGENTS | NOVARTIS CORPORATION (US) | 1998-02-17 | — | — | US | disclosed |
| EP-0702004-A2 | 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives | CIBA-GEIGY AG (CH) | 1996-03-20 | — | — | EP | disclosed |