Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.57 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.49 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.49 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL13061102 | 0.86 | CALM1 (0.64) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13005684 | 0.84 | TAAR1 (0.53) | TAAR1CALM1CAMKK2RIPK1MEN1 | |
| SCHEMBL13061111 | 0.82 | CALM1 (0.44) | TAAR1CALM1CAMKK2RIPK1MEN1 | |
| SCHEMBL13061026 | 0.82 | TAAR1 (0.57) | TAAR1CALM1CAMKK2RIPK1SIGMAR1 | |
| SCHEMBL13060708 | 0.82 | CALM1 (0.49) | CALM1CAMKK2MEN1KMT2AOPRM1 | |
| SCHEMBL13061011 | 0.82 | TAAR1 (0.57) | TAAR1CALM1CAMKK2RIPK1MEN1 | |
| SCHEMBL13061128 | 0.80 | BCHE (0.47) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13060654 | 0.80 | CALM1 (0.43) | TAAR1CALM1CAMKK2MEN1KMT2A | |
| SCHEMBL13061027 | 0.79 | CALM1 (0.47) | CALM1CAMKK2MEN1KMT2AACHE | |
| SCHEMBL13061028 | 0.79 | CYP1A2 (0.57) | CALM1CAMKK2MEN1KMT2ASIGMAR1 |
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 |