Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | TP53 | P04637 | 4/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL9465135 | 0.77 | CHRNA1 (0.40) | ALDH1A1LMNA | |
| SCHEMBL9465688 | 0.70 | NPC1 (0.61) | CYP1A2CYP2C9CYP2C19TP53KMT2A | |
| SCHEMBL9465148 | 0.67 | ALDH1A1 (0.39) | KDM4EALDH1A1TSHRMAPTTP53 | |
| SCHEMBL9466021 | 0.65 | BRD4 (0.44) | CYP1A2CYP2C9CYP2C19USP2ALDH1A1 | |
| SCHEMBL24307626 | 0.64 | NPC1 (0.58) | CYP1A2CYP19A1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9466167 | 0.64 | — | — | |
| SCHEMBL2272084 | 0.63 | CYP1A2 (0.54) | CYP1A2CYP19A1CYP2C9CYP2C19MAPT | |
| SCHEMBL9465775 | 0.61 | ESR1 (0.30) | — | |
| SCHEMBL7221763 | 0.61 | KDM4E (0.39) | CYP1A2CYP19A1CYP2C9CYP2C19KDM4E | |
| SCHEMBL9464870 | 0.61 | PDE10A (0.40) | CYP2C9KDM4EALDH1A1TP53KMT2A |
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-5246914-A | Fungicides and plant growth regulators | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-21 | — | — | US | disclosed |