Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | TLR4 | O00206 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11716947 | 1.00 | CYP1A2 (0.45) | CYP1A2MAPTDRD2DRD3TLR4 | |
| SCHEMBL15177350 | 0.95 | CYP1A2 (0.46) | CYP1A2MAPTDRD2DRD3HPGD | |
| SCHEMBL11709782 | 0.93 | TP53 (0.47) | CYP1A2DRD2DRD3HTTEPHX1 | |
| SCHEMBL11709787 | 0.93 | TP53 (0.47) | CYP1A2DRD2DRD3HTTEPHX1 | |
| SCHEMBL16556614 | 0.89 | DRD2 (0.47) | MAPTDRD2DRD3TLR4HPGD | |
| SCHEMBL11683857 | 0.89 | DRD2 (0.47) | DRD2DRD3HPGDALDH1A1EPHX1 | |
| SCHEMBL11687711 | 0.86 | DRD2 (0.50) | DRD2DRD3HPGDALDH1A1EPHX1 | |
| SCHEMBL225428 | 0.81 | DRD2 (0.47) | DRD2DRD3HPGDALDH1A1KMT2A | |
| SCHEMBL225429 | 0.81 | DRD2 (0.47) | DRD2DRD3HPGDALDH1A1KMT2A | |
| SCHEMBL17592067 | 0.81 | DRD2 (0.42) | MAPTDRD2DRD3EPHX1KMT2A |
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-4015015-A | Chemical fire alarm | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-03-29 | — | — | US | disclosed |