Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13005654 | 0.88 | CALM1 (0.37) | CALM1CAMKK2KDM4EALDH1A1TDP1 | |
| SCHEMBL172762 | 0.75 | OPRM1 (0.47) | CALM1CAMKK2 | |
| SCHEMBL13061128 | 0.74 | BCHE (0.47) | CALM1CAMKK2MEN1KMT2ATSHR | |
| SCHEMBL13061102 | 0.73 | CALM1 (0.64) | CALM1CAMKK2KDM4EALDH1A1MEN1 | |
| SCHEMBL13061093 | 0.71 | CALM1 (0.48) | CALM1CAMKK2MEN1KMT2ATSHR | |
| SCHEMBL13060683 | 0.71 | KDM4E (0.57) | CALM1CAMKK2KDM4EMEN1KMT2A | |
| SCHEMBL13061011 | 0.70 | TAAR1 (0.57) | CALM1CAMKK2KDM4EALDH1A1MEN1 | |
| SCHEMBL13060674 | 0.70 | CALM1 (0.56) | CALM1CAMKK2 | |
| SCHEMBL13061094 | 0.70 | CALM1 (0.46) | CALM1CAMKK2KDM4EALDH1A1MEN1 | |
| SCHEMBL13060692 | 0.70 | TAAR1 (0.57) | CALM1CAMKK2MEN1KMT2AHTT |
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 |