Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24331089 | 1.00 | TSHR (0.47) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL24331088 | 0.91 | SLC40A1 (0.44) | TSHRKMT2AMEN1PFKFB3ALDH1A1 | |
| SCHEMBL29515298 | 0.91 | SLC40A1 (0.44) | TSHRKMT2AMEN1PFKFB3ALDH1A1 | |
| SCHEMBL29515436 | 0.88 | KDM4E (0.43) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL24330481 | 0.88 | KDM4E (0.43) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL24330440 | 0.82 | KDM4E (0.49) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL29515251 | 0.80 | AKR1C3 (0.38) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL24330524 | 0.79 | SLC40A1 (0.43) | KMT2AMEN1PFKFB3ALDH1A1 | |
| SCHEMBL24331148 | 0.79 | KDM4E (0.42) | TSHRKDM4EPTK2BAKR1C3KMT2A | |
| SCHEMBL29515248 | 0.79 | KDM4E (0.42) | TSHRKDM4EPTK2BAKR1C3KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-4225761-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076620-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |