Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.33 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.33 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.33 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.33 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945007 | 0.90 | DHFR (0.39) | SIGMAR1DRD2TRPA1KDM1AMAOA | |
| SCHEMBL8945160 | 0.73 | HTR6 (0.36) | MAPTMAOAMAOBMEN1KMT2A | |
| SCHEMBL8945400 | 0.70 | NOS3 (0.41) | MAPTALDH1A1RAB9ABACE1MEN1 | |
| SCHEMBL10286692 | 0.70 | ALDH1A1 (0.38) | MAPTALDH1A1DHFRRAB9ABACE1 | |
| SCHEMBL8945278 | 0.70 | HTR2C (0.46) | DRD2ALDH1A1ATP1A1ATP1B1ATP1A3 | |
| SCHEMBL8945105 | 0.70 | DRD2 (0.44) | DRD2MAOAMAOBDHFRATP1A1 | |
| SCHEMBL8945167 | 0.69 | ESR2 (0.41) | MAPTALDH1A1DHFRRAB9AMEN1 | |
| SCHEMBL8945344 | 0.69 | KDM1A (0.39) | KDM1AMAOB | |
| SCHEMBL8945024 | 0.67 | CYP2C9 (0.51) | MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL9910784 | 0.67 | ALDH1A1 (0.40) | MAPTALDH1A1DHFRBACE1ATP4A |
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-5501884-A | Diamino compounds and their production method and liquid crystal alignment layers using the compounds | CHISSO CORPORATION (JP) | 1996-03-26 | — | — | US | disclosed |