Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | GRK2 | P25098 | 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 | |
|---|---|---|---|---|
| SCHEMBL8561600 | 1.00 | ALDH1A1 (0.34) | ALDH1A1CYP1A2POLBHTR2AHTR2B | |
| SCHEMBL8562540 | 0.77 | HDAC1 (0.39) | NTRK1CNR2TSHRMEN1NPC1 | |
| SCHEMBL8562543 | 0.77 | HDAC1 (0.39) | NTRK1CNR2TSHRMEN1NPC1 | |
| SCHEMBL8561161 | 0.74 | MAPT (0.35) | HTR2BNTRK1CNR2TSHRHTT | |
| SCHEMBL8561158 | 0.74 | MAPT (0.35) | HTR2BNTRK1CNR2TSHRHTT | |
| SCHEMBL10405577 | 0.69 | ALDH1A1 (0.47) | ALDH1A1CYP1A2POLBHTR2AHTR2B | |
| SCHEMBL9832588 | 0.69 | ALDH1A1 (0.47) | ALDH1A1CYP1A2POLBHTR2AHTR2B | |
| SCHEMBL8561604 | 0.69 | PPARA (0.36) | ALDH1A1TSHRPPARAKDM4ESMN1; SMN2 | |
| SCHEMBL8561601 | 0.69 | PPARA (0.36) | ALDH1A1TSHRPPARAKDM4ESMN1; SMN2 | |
| SCHEMBL5353392 | 0.60 | ABCC2 (0.43) | ALDH1A1CNR2HTTKDM4ESMN1; SMN2 |
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-0695755-B1 | Pyrrolocarbazole | HOFFMANN LA ROCHE (CH) | 1998-10-21 | — | — | EP | disclosed |
| EP-0695755-A1 | Pyrrolocarbazoles | F. Hoffmann-La Roche AG (CH) | 1996-02-07 | — | — | EP | disclosed |