Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10699642 | 0.82 | EDNRB (0.41) | EDNRBEDNRAHTR2BSIGMAR1HTR1A | |
| SCHEMBL10702160 | 0.81 | HTR2B (0.40) | EDNRBEDNRAHTR2BSIGMAR1HTR1A | |
| SCHEMBL8800043 | 0.78 | DRD2 (0.36) | EDNRBEDNRAHTR2BSIGMAR1HTR1A | |
| SCHEMBL8797672 | 0.77 | EDNRB (0.46) | EDNRBEDNRAALDH1A1MAPTGAA | |
| SCHEMBL7615965 | 0.75 | HTR1A (0.35) | EDNRBEDNRAHTR2BSIGMAR1HTR1A | |
| SCHEMBL12121841 | 0.71 | MAPT (0.50) | ALDH1A1MAPTGAAHPGDTDP1 | |
| SCHEMBL8797372 | 0.70 | LPAR1 (0.45) | EDNRBEDNRAALDH1A1MAPTHPGD | |
| Fumaric Acid SCHEMBL29896602 | 0.68 | CYP1A2 (0.36) | EDNRBEDNRAALDH1A1MAPTGAA | |
| SCHEMBL654200 | 0.68 | MAPT (0.49) | EDNRBEDNRAALDH1A1MAPTGAA | |
| SCHEMBL654789 | 0.68 | ALDH1A1 (0.66) | ALDH1A1MAPTGAAHPGDTDP1 |
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-6613905-B1 | Treating or preventing a disease associated with aberrant leukocyte recruitment and/or activation | MILLENNIUM PHARMACEUTICALS, INC. | 2003-09-02 | — | — | US | disclosed |