Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL5993759 | 0.87 | ITGB1 (0.38) | ITGB1ITGA4ESR1CNR1CNR2 | |
| SCHEMBL6374832 | 0.83 | SMN1; SMN2 (0.38) | HPGDLMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL7086681 | 0.80 | NPC1 (0.42) | POLBLMNASMN1; SMN2MEN1KMT2A | |
| Dodecane SCHEMBL8532955 | 0.77 | HPGD (0.39) | ITGB1ITGA4ESR1HPGDPOLB | |
| SCHEMBL225077 | 0.77 | GAA (0.41) | POLBLMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL28191287 | 0.76 | SMN1; SMN2 (0.37) | HPGDLMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL29548582 | 0.76 | HPGD (0.38) | ITGB1ITGA4ESR1HPGDPOLB | |
| SCHEMBL10630336 | 0.74 | CYP3A4 (0.35) | HPGDLMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL28843804 | 0.74 | ITGB1 (0.38) | ITGB1ITGA4ESR1HPGDPOLB | |
| SCHEMBL8490613 | 0.73 | ESR1 (0.58) | ESR1CNR1CNR2LMNASMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-104870456-A | Derivatives of bisacylphosphinic acids, their preparation and their use as photoinitiators | BASF SE | 2015-08-26 | — | — | CN | disclosed |