Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT1 | P54687 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | MMP14 | P50281 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6086523 | 0.90 | HTR3E (0.42) | BCAT1KDM4EKMT2ANPC1RAB9A | |
| SCHEMBL7588230 | 0.84 | FLT3 (0.50) | KMT2ANPC1RAB9AALDH1A1LMNA | |
| SCHEMBL7587322 | 0.80 | BCAT1 (0.48) | BCAT1KDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL7584637 | 0.78 | F12 (0.48) | KMT2ANPC1RAB9AMMP2MAOB | |
| SCHEMBL7591071 | 0.78 | MAOB (0.47) | BCAT1KDM4ENPC1RAB9AMAOB | |
| SCHEMBL7588263 | 0.76 | POLB (0.53) | KMT2ANPC1RAB9AALDH1A1ATM | |
| SCHEMBL7586241 | 0.71 | HTR3E (0.40) | KMT2ANPC1RAB9AALDH1A1ATM | |
| SCHEMBL4926908 | 0.71 | ALDH1A1 (0.51) | BCAT1KDM4EKMT2ANPC1RAB9A | |
| SCHEMBL30629235 | 0.71 | NPC1 (0.69) | BCAT1KDM4EKMT2ANPC1RAB9A | |
| SCHEMBL657436 | 0.71 | NPC1 (0.69) | BCAT1KDM4EKMT2ANPC1RAB9A |
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-1246795-A2 | ANTIBACTERIAL AGENTS | Tularik Inc. (US) | 2002-10-09 | — | — | EP | disclosed |
| WO-2001051456-A2 | ANTIBACTERIAL AGENTS | TULARIK INC. (US) | 2001-07-19 | — | — | WO | disclosed |