Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 9/20 | 0.40 |
| ▸ | HTR2A | P28223 | 8/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.33 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.33 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.33 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.31 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26782296 | 0.83 | HTR2C (0.36) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25897715 | 0.79 | HTR2A (0.49) | HTR2CHTR2AGRM2PSMB1PSMB5 | |
| SCHEMBL25321362 | 0.78 | AAK1 (0.41) | PSMB1PSMB5TIPARPHDAC3HDAC1 | |
| SCHEMBL25321367 | 0.78 | AAK1 (0.41) | PSMB1PSMB5TIPARPHDAC3HDAC1 | |
| SCHEMBL30550680 | 0.74 | HTR2C (0.32) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25322487 | 0.74 | HTR2C (0.32) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25898037 | 0.73 | TAF1 (0.38) | MAP2K1 | |
| SCHEMBL25320933 | 0.70 | GRM2 (0.35) | GRM2TIPARP | |
| SCHEMBL30550705 | 0.70 | GRM2 (0.35) | GRM2TIPARP | |
| SCHEMBL25320929 | 0.70 | GRM2 (0.35) | GRM2TIPARP |
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-2023147418-A1 | PARP7 INHIBITORS | GILEAD SCIENCES, INC. (US) | 2023-08-03 | — | — | WO | disclosed |