Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.44 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SLC1A5 | Q15758 | 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 | |
|---|---|---|---|---|
| SCHEMBL13005634 | 0.85 | CALM1 (0.42) | CALM1CAMKK2KDM4ELMNATSHR | |
| SCHEMBL13060673 | 0.82 | CALM1 (0.50) | CALM1CAMKK2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL10039143 | 0.80 | CALM1 (0.64) | CALM1CAMKK2CYP2D6CYP2C19KDM4E | |
| SCHEMBL13061100 | 0.78 | CALM1 (0.55) | CALM1CAMKK2KDM4ETSHRALDH1A1 | |
| SCHEMBL13005676 | 0.74 | CALM1 (0.45) | CALM1CAMKK2KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL13060654 | 0.74 | CALM1 (0.43) | CALM1CAMKK2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL13061111 | 0.73 | CALM1 (0.44) | CALM1CAMKK2KDM4ETSHRSMN1; SMN2 | |
| SCHEMBL173006 | 0.72 | CALM1 (0.43) | CALM1CAMKK2CYP3A4KDM4ETSHR | |
| SCHEMBL13061083 | 0.72 | CALM1 (0.49) | CALM1CAMKK2KDM4EHSD17B10TSHR | |
| SCHEMBL13061029 | 0.72 | MEN1 (0.49) | CALM1CAMKK2CYP2D6CYP2C19LMNA |
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 |