Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.46 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.46 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13005681 | 0.90 | CALM1 (0.48) | TAAR1CALM1CAMKK2PYCR1PTGES | |
| SCHEMBL13005440 | 0.87 | CALM1 (0.59) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13005625 | 0.85 | BCHE (0.47) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13061011 | 0.84 | TAAR1 (0.57) | TAAR1CALM1CAMKK2PYCR1SIGMAR1 | |
| SCHEMBL14181862 | 0.84 | CALM1 (0.62) | TAAR1CALM1CAMKK2PYCR1SIGMAR1 | |
| SCHEMBL13005684 | 0.83 | TAAR1 (0.53) | TAAR1CALM1CAMKK2RIPK1MEN1 | |
| SCHEMBL13005692 | 0.83 | TSHR (0.54) | TAAR1CALM1CAMKK2PYCR1RIPK1 | |
| SCHEMBL13005720 | 0.83 | OPRK1 (0.49) | CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13005422 | 0.83 | CALM1 (0.48) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL14027648 | 0.82 | TAAR1 (0.58) | TAAR1CALM1CAMKK2PYCR1SIGMAR1 |
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-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |