Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | UBE2M | P61081 | 4/20 | 0.38 |
| ▸ | DCUN1D1 | Q96GG9 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4351294 | 0.90 | ALDH1A1 (0.39) | TP53LMNAPTK2MEN1KMT2A | |
| SCHEMBL4354386 | 0.88 | CCR2 (0.41) | ACHETP53LMNAMEN1KMT2A | |
| SCHEMBL4359597 | 0.85 | LMNA (0.42) | ACHELMNAMEN1KMT2AMAPT | |
| SCHEMBL4920592 | 0.84 | MAPT (0.42) | TP53LMNAMEN1KMT2AMAPT | |
| SCHEMBL3318296 | 0.81 | BLM (0.43) | TP53LMNAMEN1KMT2AUBE2M | |
| SCHEMBL4345577 | 0.81 | HDAC3 (0.36) | MEN1KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL4347969 | 0.81 | EGFR (0.43) | TP53LMNAMEN1KMT2AMAPT | |
| SCHEMBL4347110 | 0.81 | EGFR (0.43) | MEN1KMT2AMAPTNPC1RAB9A | |
| SCHEMBL4341341 | 0.80 | RAB9A (0.36) | LMNAMEN1KMT2AUBE2MDCUN1D1 | |
| SCHEMBL4345516 | 0.79 | ALOX15 (0.48) | TP53LMNAMEN1KMT2AMAPT |
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-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | claimed |
| EP-2100876-A2 | New compounds for the inhibition of rotamases and use thereof | Jerini AG (DE) | 2009-09-16 | — | — | EP | disclosed |