Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 12/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 12/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | FBP1 | P09467 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8546041 | 1.00 | CYP1A1 (0.52) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL2622608 | 0.86 | CYP1A1 (0.59) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL7567897 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL13790243 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL8367958 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL13790333 | 0.81 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL27960203 | 0.78 | ALDH1A1 (0.61) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL2091166 | 0.77 | CYP1A1 (0.55) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL2091163 | 0.77 | CYP1A1 (0.55) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 | |
| SCHEMBL2622629 | 0.77 | CYP1A2 (0.53) | CYP1A1CYP1B1CYP1A2ALDH1A1FBP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0690842-B1 | 4-ARYLISOINDOLE ANALGESICS | ORTHO PHARMA CORP (US) | 1998-12-16 | — | — | EP | disclosed |
| US-5508424-A | REDUCED SIDE EFFECTS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1996-04-16 | — | — | US | disclosed |
| EP-0690842-A1 | 4-ARYLISOINDOLE ANALGESICS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1996-01-10 | — | — | EP | disclosed |
| WO-1994022823-A1 | 4-ARYLISOINDOLE ANALGESICS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1994-10-13 | — | — | WO | disclosed |