Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.65 |
| ▸ | CASP3 | P42574 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.65 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.65 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.65 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.63 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.63 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.63 |
| ▸ | NPC1 | O15118 | 5/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | TP53 | P04637 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | PPARA | Q07869 | 7/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4313968 | 0.82 | RAB9A (0.59) | RAB9AALDH1A1MEN1CASP3KMT2A | |
| SCHEMBL3109486 | 0.81 | SMN1; SMN2 (0.64) | RAB9AALDH1A1MEN1CASP3KMT2A | |
| SCHEMBL15062479 | 0.80 | SMN1; SMN2 (0.51) | RAB9AALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL15062501 | 0.79 | S1PR1 (0.46) | RAB9AALDH1A1MEN1CASP3KMT2A | |
| SCHEMBL1422890 | 0.78 | CHRNB2 (1.00) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL2657248 | 0.75 | CHRNB2 (0.69) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL2463534 | 0.75 | SMN1; SMN2 (0.93) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL9233042 | 0.75 | CHRNB2 (0.69) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL27768478 | 0.74 | CHRNB2 (0.63) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 | |
| SCHEMBL3685718 | 0.73 | CHRNB2 (0.83) | RAB9AALDH1A1CHRNB2CHRNA5CHRNA4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2610244-A1 | Indole compounds | Ironwood Pharmaceuticals, Inc. (US) | 2013-07-03 | — | — | EP | disclosed |
| CN-102850324-A | Indole compounds | MICROBIA INC | 2013-01-02 | — | — | CN | disclosed |
| CN-101563337-A | Indole compounds | MICROBIA INC (US) | 2009-10-21 | — | — | CN | disclosed |
| EP-2049520-A2 | INDOLE COMPOUNDS | Ironwood Pharmaceuticals, Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008019357-A2 | INDOLE COMPOUNDS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2008-02-14 | — | — | WO | disclosed |