Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 18/20 | 0.72 |
| ▸ | RGS12 | O14924 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | LCK | P06239 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.61 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9163440 | 0.84 | EGFR (1.00) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL9248938 | 0.81 | EGFR (0.63) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL10172851 | 0.80 | EGFR (0.72) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL11510755 | 0.79 | EGFR (0.71) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL2989135 | 0.78 | EGFR (0.80) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL11981619 | 0.77 | EGFR (0.79) | EGFRRGS12ALDH1A1LCKMAPT | |
| Hydrochloric Acid SCHEMBL2992201 | 0.77 | EGFR (0.77) | EGFRRGS12ALDH1A1LCKMAPT | |
| Lavendustin C SCHEMBL30569227 | 0.76 | EGFR (1.00) | EGFRRGS12ALDH1A1LCKMAPT | |
| Lavendustin C SCHEMBL1821516 | 0.76 | EGFR (1.00) | EGFRRGS12ALDH1A1LCKMAPT | |
| SCHEMBL7809216 | 0.75 | EGFR (0.81) | EGFRRGS12ALDH1A1LCKMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641311-A1 | NOVEL DIHYDROXYBENZYLAMINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | Aventis Pharma S.A. (FR) | 1995-03-08 | — | — | EP | disclosed |
| WO-1993023364-A1 | NOVEL DIHYDROXYBENZYLAMINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | RHONE-POULENC RORER S.A. (FR) | 1993-11-25 | — | — | WO | disclosed |