Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2002616 | 0.93 | ALDH1A1 (0.45) | ALDH1A1LMNAKDM4EMEN1USP2 | |
| SCHEMBL2006285 | 0.91 | HSD17B10 (0.39) | ALDH1A1LMNAKDM4EMEN1POLB | |
| SCHEMBL1998318 | 0.90 | HDAC6 (0.44) | ALDH1A1LMNAKDM4EMEN1USP2 | |
| SCHEMBL2006426 | 0.90 | LMNA (0.43) | ALDH1A1LMNAMEN1POLBKMT2A | |
| SCHEMBL2007363 | 0.88 | ALOX5AP (0.40) | ALDH1A1LMNAKDM4EMEN1POLB | |
| SCHEMBL2004831 | 0.88 | PTGES2 (0.38) | ALDH1A1LMNAKDM4EMEN1USP2 | |
| SCHEMBL2001978 | 0.88 | FAAH (0.45) | ALDH1A1KDM4EMEN1KMT2ACYP2C9 | |
| SCHEMBL2004673 | 0.87 | ALDH1A1 (0.39) | ALDH1A1LMNAKDM4EMEN1USP2 | |
| SCHEMBL2002436 | 0.86 | LMNA (0.55) | ALDH1A1LMNAKDM4EMEN1USP2 | |
| SCHEMBL2006836 | 0.86 | MCL1 (0.40) | ALDH1A1LMNAKDM4EMEN1USP2 |
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-7960544-B2 | Useful indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |