Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 1.00 |
| ▸ | LMNA | P02545 | 1/20 | 0.81 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.60 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.60 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | EGFR | P00533 | 3/20 | 0.57 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3380975 | 1.00 | TDP1 (1.00) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3380977 | 1.00 | TDP1 (1.00) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL27898809 | 1.00 | TDP1 (1.00) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28755618 | 0.91 | TDP1 (0.83) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6673267 | 0.87 | TDP1 (0.76) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6673273 | 0.87 | TDP1 (0.76) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6673269 | 0.87 | TDP1 (0.76) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3022080 | 0.85 | TDP1 (0.72) | TDP1LMNACYP3A4CYP2C9ALDH1A1 | |
| N-Isopropylcinnamamide SCHEMBL6751570 | 0.84 | TDP1 (0.73) | TDP1LMNACYP1A2CYP3A4CYP2C9 | |
| N-Isopropylcinnamamide SCHEMBL6751573 | 0.84 | TDP1 (0.73) | TDP1LMNACYP1A2CYP3A4CYP2C9 |
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-2010059922-A1 | PYRROLIDINE CARBOXAMIDE COMPOUNDS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2010-05-27 | — | — | WO | disclosed |