Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11149450 | 0.87 | FBP1 (0.47) | HSP90AA1MAPTMAPK1FBP1SMN1; SMN2 | |
| SCHEMBL27610822 | 0.79 | TAAR1 (0.48) | TAAR1SMN1; SMN2RAB9ANPC1IDO1 | |
| SCHEMBL10819077 | 0.79 | HSPA5 (0.42) | TAAR1FBP1CYP2D6IDO1TSHR | |
| SCHEMBL6263863 | 0.76 | RXRA (0.54) | MAPTL3MBTL1FBP1SMN1; SMN2RAB9A | |
| SCHEMBL11670151 | 0.75 | PNMT (0.52) | TAAR1SMN1; SMN2RAB9ANPC1CYP3A4 | |
| SCHEMBL6157849 | 0.75 | PNMT (0.52) | TAAR1SMN1; SMN2RAB9ANPC1CYP3A4 | |
| SCHEMBL27617503 | 0.75 | TAAR1 (0.48) | TAAR1SMN1; SMN2RAB9ANPC1CYP3A4 | |
| SCHEMBL8440818 | 0.75 | ALDH1A1 (0.51) | MAPTMAPK1FBP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27610469 | 0.73 | TAAR1 (0.47) | TAAR1SMN1; SMN2RAB9ANPC1IDO1 | |
| SCHEMBL15093965 | 0.73 | MAOB (0.56) | HSP90AA1MAPTMAPK1FBP1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6255542-B1 | RING CHLORINATING 4-NITROALKYLBENZENE WITH CHLORINE OR CHLORING-RELEASING AGENT IN A LIQUID PHASE AND IN THE PRESENCE OF A FRIEDEL-CRAFTS CATALYST AND A DIARYL SULFIDE CO-CATALYST | BAYER AKTIENGESELLSCHAFT (DE) | 2001-07-03 | — | — | US | disclosed |