Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 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 | |
|---|---|---|---|---|
| SCHEMBL24330515 | 1.00 | ALDH1A1 (0.43) | ALDH1A1AKR1C3LOXL2KMT2AMEN1 | |
| SCHEMBL26807160 | 0.92 | CA12 (0.41) | ALDH1A1AKR1C3KMT2AMEN1TSHR | |
| SCHEMBL24309603 | 0.91 | POLB (0.45) | ALDH1A1TSHRSMN1; SMN2POLB | |
| SCHEMBL26807174 | 0.87 | CA12 (0.39) | ALDH1A1F2F10TSHRSMN1; SMN2 | |
| SCHEMBL26807133 | 0.86 | PGR (0.42) | TSHRSMN1; SMN2POLBCCR2 | |
| SCHEMBL29567277 | 0.86 | PGR (0.42) | TSHRSMN1; SMN2POLBCCR2 | |
| SCHEMBL26807167 | 0.86 | MAPT (0.45) | ALDH1A1TSHRSMN1; SMN2POLB | |
| SCHEMBL26807176 | 0.84 | PLA2G7 (0.46) | KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL29567014 | 0.84 | TSHR (0.39) | ALDH1A1F2TSHRSMN1; SMN2POLB | |
| SCHEMBL24309292 | 0.84 | TSHR (0.39) | ALDH1A1F2TSHRSMN1; SMN2POLB |
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-4225763-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076626-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |