Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.33 |
| ▸ | F13A1 | P00488 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL743446 | 0.83 | HDAC8 (0.45) | TSHRKDM4EF13A1KMT2AHDAC3 | |
| SCHEMBL295483 | 0.80 | CYP4A11 (0.50) | TSHRKDM4EF13A1 | |
| SCHEMBL6670487 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL60234 | 0.74 | AKR1C3 (0.48) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL11105167 | 0.72 | AKR1C3 (0.62) | CES2CES1ALDH1A1TRPA1TSHR | |
| SCHEMBL11105164 | 0.72 | AKR1C3 (0.62) | CES2CES1ALDH1A1TRPA1TSHR | |
| SCHEMBL29638051 | 0.71 | ABCG2 (0.39) | CES2CES1ALDH1A1TRPA1SMN1; SMN2 | |
| SCHEMBL11641546 | 0.71 | SMN1; SMN2 (0.59) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL1501994 | 0.71 | KMT2A (0.63) | ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL4661731 | 0.70 | TRPA1 (0.39) | CES2CES1ALDH1A1TRPA1TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0495013-B1 | HEXAPEPTIDES WITH SULPHATE ESTER GROUPS | FISONS CORP (US) | 1995-03-08 | — | — | EP | disclosed |
| EP-0619823-A1 | PEPTIDE COMPOUNDS HAVING THERAPEUTIC ACTIVITY | Astra Aktiebolag (SE) | 1994-10-19 | — | — | EP | disclosed |
| EP-0226217-B1 | Peptides with sulfate ester group | FISONS CORP (US) | 1994-01-26 | — | — | EP | disclosed |
| WO-1993013126-A1 | PEPTIDE COMPOUNDS HAVING THERAPEUTIC ACTIVITY | FISONS CORPORATION (US) | 1993-07-08 | — | — | WO | disclosed |