Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 14/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | USP9X | Q93008 | 1/20 | 0.35 |
| ▸ | F13A1 | P00488 | 1/20 | 0.35 |
| ▸ | TGM2 | P21980 | 1/20 | 0.35 |
| ▸ | TGM1 | P22735 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21496890 | 0.92 | ALDH1A1 (0.41) | ALDH1A1LMNAPOLBPKM | |
| SCHEMBL21512971 | 0.87 | ALDH1A1 (0.39) | F10ALDH1A1LMNAPOLB | |
| SCHEMBL21512153 | 0.82 | ALDH1A1 (0.47) | F10ALDH1A1F13A1TGM2TGM1 | |
| SCHEMBL21512799 | 0.82 | ALDH1A1 (0.47) | F10ALDH1A1F13A1TGM2TGM1 | |
| SCHEMBL21512972 | 0.82 | F10 (0.37) | F10ALDH1A1LMNAPOLBCYP3A4 | |
| SCHEMBL21511691 | 0.82 | ALDH1A1 (0.53) | F10ALDH1A1POLBPKM | |
| SCHEMBL21512973 | 0.80 | F10 (0.38) | F10ALDH1A1LMNAPOLBCYP3A4 | |
| SCHEMBL21194421 | 0.80 | DPP4 (0.38) | F10ALDH1A1LMNAPOLBUSP9X | |
| SCHEMBL21512796 | 0.79 | F10 (0.45) | F10ALDH1A1CYP2D6PKM | |
| SCHEMBL22124443 | 0.73 | TACR3 (0.36) | POLBPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019204505-A2 | K-RAS MODULATORS WITH A VINYL SULFONAMIDE MOIETY | THERAS, INC. (US) | 2019-10-24 | — | — | WO | disclosed |