Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.57 |
| ▸ | LNPEP | Q9UIQ6 | 3/20 | 0.52 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 4/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4800831 | 1.00 | TACR1 (0.57) | TACR1LNPEPERAP2LCKERAP1 | |
| SCHEMBL27578169 | 0.88 | TACR1 (0.71) | TACR1LCKNOS2HDAC1HDAC6 | |
| SCHEMBL4799488 | 0.86 | LMNA (0.52) | TACR1CA2 | |
| SCHEMBL4799500 | 0.86 | LMNA (0.52) | TACR1CA2 | |
| SCHEMBL26699643 | 0.84 | KLK5 (0.51) | TACR1LNPEPLCK | |
| SCHEMBL26699639 | 0.84 | KLK5 (0.51) | TACR1LNPEPLCK | |
| SCHEMBL8238664 | 0.83 | ALDH1A1 (0.51) | TACR1LNPEPERAP2ERAP1 | |
| SCHEMBL1108337 | 0.83 | TACR1 (0.59) | TACR1LNPEPERAP2LCKERAP1 | |
| SCHEMBL6501256 | 0.83 | LNPEP (0.51) | TACR1LNPEPERAP2LCKERAP1 | |
| SCHEMBL6501251 | 0.83 | LNPEP (0.51) | TACR1LNPEPERAP2LCKERAP1 |
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-1737842-A1 | SELECTED CGRP ANTAGONISTS, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF AS DRUGS | Boehringer Ingelheim International GmbH (DE) | 2007-01-03 | — | — | EP | disclosed |
| WO-2005100343-A1 | SELECTED CGRP ANTAGONISTS, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF AS DRUGS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-10-27 | — | — | WO | disclosed |