Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | MAOA | P21397 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SCN1A | P35498 | 2/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 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 | |
|---|---|---|---|---|
| SCHEMBL11868608 | 0.82 | TDP1 (0.57) | LMNACYP1A2NPC1RAB9AMAPT | |
| SCHEMBL14451127 | 0.82 | CA12 (0.57) | LMNACYP1A2TSHRCYP2C19NPC1 | |
| SCHEMBL11743861 | 0.80 | CES2 (0.46) | LMNANPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL11748874 | 0.80 | ALDH1A1 (0.49) | TSHRNPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL1020413 | 0.79 | TSHR (0.56) | LMNATSHRMAPTALDH1A1SLC6A3 | |
| SCHEMBL12673729 | 0.78 | CA1 (0.62) | LMNACYP1A2CYP2C9CYP2C19MAPT | |
| SCHEMBL22589065 | 0.78 | PBRM1 (0.49) | LMNATSHRNPC1ALDH1A1NPSR1 | |
| SCHEMBL27668297 | 0.78 | TSHR (0.54) | LMNATSHRMAPTALDH1A1SLC6A3 | |
| SCHEMBL27647867 | 0.78 | TSHR (0.54) | LMNATSHRMAPTALDH1A1SLC6A3 | |
| SCHEMBL28753725 | 0.77 | PBRM1 (0.47) | LMNATSHRNPC1ALDH1A1NPSR1 |
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-0923533-A1 | HYDROGENATION OF AROMATIC NITROCOMPOUNDS TO AROMATIC AMINES | VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) | 1999-06-23 | — | — | EP | disclosed |
| WO-1997030967-A1 | HYDROGENATION OF AROMATIC NITROCOMPOUNDS TO AROMATIC AMINES | VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) | 1997-08-28 | — | — | WO | disclosed |