Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CMA1 | P23946 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL9418976 | 0.88 | ALDH1A1 (0.39) | CMA1AHRHTR2AHTR2CHTR2B | |
| SCHEMBL9418964 | 0.75 | CMA1 (0.42) | CMA1AHRALDH1A1TDP2KMT2A | |
| SCHEMBL7796330 | 0.72 | CMA1 (0.47) | CMA1AHRALDH1A1TDP2 | |
| SCHEMBL9418949 | 0.71 | CMA1 (0.42) | CMA1AHRALDH1A1TDP2 | |
| SCHEMBL7928975 | 0.71 | ADRA2A (0.40) | CMA1AHRHTR2AHTR2CHTR2B | |
| SCHEMBL8370875 | 0.68 | TDP2 (0.47) | CMA1AHRALDH1A1TDP2ADRA2A | |
| SCHEMBL3361527 | 0.67 | PGR (0.55) | CMA1AHRHTR2AHTR2CALDH1A1 | |
| SCHEMBL14169119 | 0.67 | PBRM1 (0.54) | HTR2AHTR2CHTR2BPBRM1OPRM1 | |
| SCHEMBL26656332 | 0.67 | PBRM1 (0.54) | HTR2AHTR2CHTR2BPBRM1OPRM1 | |
| SCHEMBL9419023 | 0.67 | TDP2 (0.42) | CMA1AHRTDP2PNMT |
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-0315071-B1 | Benzocyclohepten derivatives, their preparation and utilisation for pharmaceutics | HOFFMANN LA ROCHE (CH) | 1994-07-20 | — | — | EP | disclosed |
| US-4992574-A | Skin disorders, antiallergens, antiinflammatory agent | HOFFMANN-LA ROCHE INC. (US) | 1991-02-12 | — | — | US | disclosed |