Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | GRK2 | P25098 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7861566 | 0.91 | ROCK2 (0.41) | ROCK2GRK2TP53ITGB3ITGB1 | |
| SCHEMBL8524582 | 0.84 | ROCK2 (0.40) | LMNAROCK2ALDH1A1TP53ITGB3 | |
| SCHEMBL8524765 | 0.77 | AKR1C3 (0.54) | LMNANPC1RAB9AHDAC2HDAC8 | |
| SCHEMBL8525720 | 0.74 | HDAC11 (0.44) | ROCK2NPC1RAB9AHDAC2HDAC8 | |
| SCHEMBL7919632 | 0.72 | ITGB3 (0.49) | ITGB3ITGB1ITGAVITGA5ITGB5 | |
| SCHEMBL7863185 | 0.68 | AKR1C3 (0.56) | LMNANPC1RAB9AHDAC2HDAC8 | |
| SCHEMBL7456073 | 0.67 | ITGB3 (0.59) | NPC1RAB9ASMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL7456078 | 0.67 | ITGB3 (0.59) | NPC1RAB9ASMN1; SMN2ITGB3ITGB1 | |
| SCHEMBL7856464 | 0.67 | TP53 (0.49) | LMNAROCK2ALDH1A1TP53ITGB3 | |
| SCHEMBL7856468 | 0.66 | TP53 (0.46) | LMNAHDAC2HDAC8HDAC6ALDH1A1 |
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-0889877-A1 | META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS | G.D. SEARLE & CO. (US) | 1999-01-13 | — | — | EP | claimed |
| WO-1997036862-A1 | META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS | G.D. SEARLE & CO. (US) | 1997-10-09 | — | — | WO | claimed |