Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.37 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.37 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.37 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.37 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.37 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.37 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.37 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.37 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.37 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.37 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.37 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.37 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL108285 | 0.95 | HTR2A (0.42) | HTR2AHTR2CMTNR1AMTNR1BGPR35 | |
| SCHEMBL29670034 | 0.95 | HTR2A (0.42) | HTR2AHTR2CMTNR1AMTNR1BGPR35 | |
| SCHEMBL29803617 | 0.91 | GPR35 (0.42) | HTR2AHTR2CMTNR1AMTNR1BTUBB4A | |
| SCHEMBL108725 | 0.91 | GPR35 (0.42) | HTR2AHTR2CMTNR1AMTNR1BTUBB4A | |
| Hydrochloric Acid SCHEMBL4625202 | 0.90 | GPR35 (0.41) | HTR2AHTR2CMTNR1AMTNR1BTUBB4A | |
| Bromide SCHEMBL4625441 | 0.90 | GPR35 (0.41) | HTR2AHTR2CMTNR1AMTNR1BTUBB4A | |
| SCHEMBL29915749 | 0.85 | ALDH1A1 (0.43) | HTR2AHTR2CMTNR1AMTNR1BTNF | |
| SCHEMBL111621 | 0.85 | ALDH1A1 (0.43) | HTR2AHTR2CMTNR1AMTNR1BTNF | |
| SCHEMBL1881998 | 0.82 | CDK4 (0.46) | HTR2AHTR2CTNFPLGPLAU | |
| SCHEMBL8814515 | 0.79 | HTR2A (0.40) | HTR2AHTR2CTNFPLGPLAU |
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-1304994-A1 | PYRROLYL-SUBSTITUTED NITROPHENOLS USED AS DIRECT COLORANTS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-05-02 | — | — | EP | disclosed |
| WO-2002009661-A1 | PYRROLYL-SUBSTITUTED NITROPHENOLS USED AS DIRECT COLORANTS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-02-07 | — | — | WO | disclosed |