Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLL | Q9UGP5 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.33 |
| ▸ | RXRA | P19793 | 4/20 | 0.33 |
| ▸ | RXRB | P28702 | 4/20 | 0.33 |
| ▸ | RXRG | P48443 | 4/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5606539 | 0.93 | ADRA1A (0.36) | ADRA1A | |
| SCHEMBL5607419 | 0.77 | HTR1A (0.42) | ADRB2ADRB1TSHRLMNAADRA1A | |
| SCHEMBL29371571 | 0.76 | ACHE (0.40) | POLLKDM4ETP53CYP1A2TSHR | |
| SCHEMBL7156116 | 0.76 | ACHE (0.40) | POLLKDM4ETP53CYP1A2TSHR | |
| SCHEMBL3656477 | 0.67 | — | — | |
| SCHEMBL3657142 | 0.65 | HTR1A (0.42) | ADRB2ADRB1TSHRLMNAADRA1A | |
| SCHEMBL18018510 | 0.65 | NISCH (0.33) | POLL | |
| SCHEMBL16348964 | 0.64 | CYP1A2 (0.40) | KDM4ECYP1A2TSHRADRA1A | |
| SCHEMBL2417663 | 0.64 | HTR1A (0.44) | ADRB2ADRB1TSHRLMNAADRA1A | |
| SCHEMBL2546030 | 0.62 | ALDH1A1 (0.52) | RXRARXRBRXRGKDM4ECYP1A2 |
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-2729479-A1 | CATALYSTS | Borealis AG (AT) | 2014-05-14 | — | — | EP | disclosed |
| WO-2013007650-A1 | CATALYSTS | BOREALIS AG (AT) | 2013-01-17 | — | — | WO | disclosed |