Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8489162 | 0.99 | ALDH1A1 (0.44) | ALDH1A1CASP1CASP7KDM4EMEN1 | |
| SCHEMBL10549228 | 0.96 | ALDH1A1 (0.45) | ALDH1A1CASP1CASP7KDM4EMEN1 | |
| SCHEMBL3052373 | 0.87 | RAB9A (0.44) | ALDH1A1CASP1CASP7MAPTTSHR | |
| SCHEMBL3048656 | 0.86 | NPC1 (0.43) | ALDH1A1CASP1CASP7POLBGAA | |
| SCHEMBL30140451 | 0.86 | NPC1 (0.43) | ALDH1A1CASP1CASP7POLBGAA | |
| SCHEMBL3182576 | 0.85 | DRD4 (0.50) | ALDH1A1KDM4EGAAMAPTTSHR | |
| SCHEMBL2035552 | 0.82 | RAB9A (0.49) | ALDH1A1KDM4EMEN1POLBMAPT | |
| SCHEMBL15260164 | 0.82 | ALDH1A1 (0.43) | ALDH1A1CASP1CASP7POLBGAA | |
| SCHEMBL15651365 | 0.81 | DRD4 (0.51) | KDM4EGAAMAPTHTTTSHR | |
| SCHEMBL14320514 | 0.81 | DRD4 (0.51) | KDM4EGAAMAPTHTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999065891-A1 | NOVEL 2,4-DIAMINOPHENOL DERIVATIVES AND THE USE THEREOF | HANS SCHWARZKOPF GMBH & CO. KG (DE) | 1999-12-23 | — | — | WO | claimed |
| WO-1999065891-A1 | NOVEL 2,4-DIAMINOPHENOL DERIVATIVES AND THE USE THEREOF | HANS SCHWARZKOPF GMBH & CO. KG (DE) | 1999-12-23 | — | — | WO | disclosed |