Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TOP1 | P11387 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SI | P14410 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochlorthiazide SCHEMBL27557458 | 0.87 | MAPK1 (0.51) | MAPTSMN1; SMN2ALDH1A1LMNAPKM | |
| Nitrobenzene SCHEMBL27321664 | 0.86 | ALDH1A1 (0.57) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| Nitrobenzene SCHEMBL29287493 | 0.85 | ALDH1A1 (0.55) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| Hydrochlorthiazide SCHEMBL27715568 | 0.81 | TP53 (0.52) | MAPTSMN1; SMN2ALDH1A1TSHRCYP1A2 | |
| Hydrochlorthiazide SCHEMBL27682551 | 0.81 | TSHR (0.46) | NPC1RAB9AMAPTALDH1A1TDP1 | |
| Hydrochlorthiazide SCHEMBL27382645 | 0.81 | ALDH1A1 (0.65) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| Hydrochlorthiazide SCHEMBL27718201 | 0.81 | TSHR (0.46) | NPC1MAPTALDH1A1TDP1LMNA | |
| Hydrochlorthiazide SCHEMBL27670045 | 0.81 | TSHR (0.65) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| 3-Nitroaniline SCHEMBL27496538 | 0.81 | ALDH1A1 (0.65) | MAPTALDH1A1TDP1LMNAMGAM | |
| SCHEMBL29526232 | 0.81 | TSHR (0.67) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1303043-C | Process for producing biaryl compound | SUMITOMO CHEMICAL CO (JP) | 2007-03-07 | — | — | CN | disclosed |
| CN-1642879-A | Process for preparing diaryl compounds | SUMITOMO CHEMICAL CO (JP) | 2005-07-20 | — | — | CN | disclosed |