Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 9/20 | 0.60 |
| ▸ | QPCT | Q16769 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11383484 | 0.86 | TBXAS1 (0.58) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11384785 | 0.85 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11385971 | 0.83 | TBXAS1 (0.61) | TBXAS1QPCTCYP1A2USP2LMNA | |
| SCHEMBL11385132 | 0.82 | TBXAS1 (0.54) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11378803 | 0.82 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11378193 | 0.82 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11383453 | 0.82 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11397028 | 0.82 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11381787 | 0.82 | TBXAS1 (0.56) | TBXAS1CYP1A2USP2LMNAMEN1 | |
| SCHEMBL11390231 | 0.81 | TBXAS1 (0.53) | TBXAS1CYP1A2LMNAMEN1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4285961-A | MICROBIOCIDES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-08-25 | — | — | US | disclosed |